SCHEMBL17005226

SCHEMBL17005226

Cc1nsc(-c2nnc3n2CCN(C(=O)c2ccccc2)C3C)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 20/20 1.00
KCNH2 Q12809 13/20 1.00
CYP2C9 P11712 4/20 1.00
CYP2C19 P33261 4/20 1.00
CYP1A2 P05177 3/20 1.00
CYP3A4 P08684 3/20 1.00
TACR1 P25103 4/20 0.83
CYP2D6 P10635 2/20 0.83
TACR2 P21452 4/20 0.79

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16143073 1.00 TACR3 (1.00) TACR3KCNH2CYP2C9CYP2C19CYP1A2
SCHEMBL16143075 0.92 TACR3 (1.00) TACR3KCNH2CYP2C9CYP2C19CYP1A2
SCHEMBL17005283 0.92 TACR3 (1.00) TACR3KCNH2CYP2C9CYP2C19CYP1A2
SCHEMBL30627746 0.91 TACR3 (0.86) TACR3KCNH2CYP2C9CYP2C19CYP1A2
SCHEMBL16114677 0.91 TACR3 (1.00) TACR3KCNH2CYP2C9CYP2C19CYP1A2
SCHEMBL16114622 0.91 TACR3 (1.00) TACR3KCNH2CYP2C9CYP2C19CYP1A2
Fezolinetant SCHEMBL16114810 0.90 TACR3 (1.00) TACR3KCNH2CYP2C9CYP2C19CYP1A2
Fezolinetant SCHEMBL16114618 0.90 TACR3 (1.00) TACR3KCNH2CYP2C9CYP2C19CYP1A2
Fezolinetant SCHEMBL23148490 0.89 TACR3 (0.98) TACR3KCNH2CYP2C9CYP2C19CYP1A2
Fezolinetant SCHEMBL23148505 0.89 TACR3 (0.98) TACR3KCNH2CYP2C9CYP2C19CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10183948-B2 N-acyl-(3-substituted)-(8-substituted)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists OGEDA SA (BE) 2019-01-22 US claimed
US-10030025-B2 Substituted [1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists OGEDA SA (BE) 2018-07-24 US claimed
US-9987274-B2 N-acyl-(3-substituted)-(8-substituted)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists OGEDA SA (BE) 2018-06-05 US claimed
US-20180111943-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2018-04-26 US claimed
EP-2948455-B1 N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO- [1,2,4]TRIAZOLO[4,3-A]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA S A (FR) 2017-09-27 EP claimed
EP-3219715-A1 N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO- [1,2,4]TRIAZOLO[4,3-A]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2017-09-20 EP claimed
US-20170240551-A9 SUBSTITUTED [1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS OGEDA SA (BE) 2017-08-24 US claimed
US-20170095472-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2017-04-06 US claimed
US-20160318941-A1 SUBSTITUTED [1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS EUROSCREEN SA (BE) 2016-11-03 US claimed
US-20150232471-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2015-08-20 US claimed
US-20240199618-A1 NOVEL N-ACYL-[3-SUBSTITUTED]-[8-SUBSTITUTED]-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2024-06-20 US disclosed
EP-3271015-B1 NK-3 RECEPTOR ANTAGONISTS FOR THERAPEUTIC OR COSMETIC TREATMENT OF EXCESS BODY FAT OGEDA S A (BE) 2023-09-27 EP disclosed
US-11731974-B2 N-acyl-(3-substituted)-(8-substituted)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists OGEDA SA (BE) 2023-08-22 US disclosed
US-20230039022-A1 NK-3 RECEPTOR ANTAGONISTS FOR THERAPEUTIC OR COSMETIC TREATMENT OF EXCESS BODY FAT OGEDA SA (BE) 2023-02-09 US disclosed
US-20210094959-A1 NOVEL N-ACYL-[3-SUBSTITUTED]-[8-SUBSTITUTED]-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2021-04-01 US disclosed
US-20170240551-A9 SUBSTITUTED [1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS OGEDA SA (BE) 2017-08-24 US disclosed
US-20170095472-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2017-04-06 US disclosed
US-20160318941-A1 SUBSTITUTED [1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS EUROSCREEN SA (BE) 2016-11-03 US disclosed
US-9422299-B2 Substituted [1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists EUROSCREEN SA (BE) 2016-08-23 US disclosed
US-20150232471-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS OGEDA SA (BE) 2015-08-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210094959-A1 NOVEL N-ACYL-[3-SUBSTITUTED]-[8-SUBSTITUTED]-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS PKD1, FFAR3, GPR3 TACR3 102/4885KCNH2 134/4885CYP2C9 1899/4885
US-20240199618-A1 NOVEL N-ACYL-[3-SUBSTITUTED]-[8-SUBSTITUTED]-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS PKD1, FFAR3, GPR3 TACR3 102/4885KCNH2 134/4885CYP2C9 1899/4885
US-20150232471-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS GPR3, KCNK3, ACKR3 TACR3 20/4885KCNH2 77/4885CYP2C9 2409/4885
US-20180111943-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS PKD1, GPR3, FFAR3 TACR3 104/4885KCNH2 139/4885CYP2C9 1839/4885
US-20170240551-A9 SUBSTITUTED [1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS GPR3, ACKR3, KCNK3 TACR3 21/4885KCNH2 75/4885CYP2C9 2925/4885
US-20160318941-A1 SUBSTITUTED [1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS GPR3, ACKR3, KCNK3 TACR3 21/4885KCNH2 75/4885CYP2C9 2925/4885
US-10183948-B2 N-acyl-(3-substituted)-(8-substituted)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists PKD1, KISS1R, PKD2 TACR3 98/4885KCNH2 131/4885CYP2C9 1511/4885
US-10030025-B2 Substituted [1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists GPR3, ACKR3, KCNK3 TACR3 21/4885KCNH2 75/4885CYP2C9 2925/4885
US-20230039022-A1 NK-3 RECEPTOR ANTAGONISTS FOR THERAPEUTIC OR COSMETIC TREATMENT OF EXCESS BODY FAT MC3R, ACKR3, PROKR1 TACR3 24/4885KCNH2 820/4885CYP2C9 4826/4885
US-20170095472-A1 NOVEL N-ACYL-(3-SUBSTITUTED)-(8-SUBSTITUTED)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[4,3-a]PYRAZINES AS SELECTIVE NK-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR USE IN NK-3 RECEPTOR-MEDIATED DISORDERS KCNK3, KCNK5, KCNN3 TACR3 119/4885KCNH2 19/4885CYP2C9 1148/4885
US-11731974-B2 N-acyl-(3-substituted)-(8-substituted)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazines as selective NK-3 receptor antagonists PKD1, KISS1R, PKD2 TACR3 98/4885KCNH2 131/4885CYP2C9 1511/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.