SCHEMBL191834

SCHEMBL191834

Clc1ncnc2c1CCC2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
DRD1 P21728 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
MAPK1 P28482 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NSD2 O96028 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
ACHE P22303 5/20 0.33
GRIN1 Q05586 5/20 0.33
GRIN2A Q12879 5/20 0.33
BCHE P06276 4/20 0.33
KDM4E B2RXH2 1/20 0.33
BPTF Q12830 1/20 0.32
OPRK1 P41145 2/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL855087 0.95 TSHR (0.37) TSHRDRD1HTR2AHTR2CHTR2B
SCHEMBL30666837 0.95 TSHR (0.37) TSHRDRD1HTR2AHTR2CHTR2B
SCHEMBL19827177 0.93 TSHR (0.36) TSHRHTR2AHTR2CHTR2BMAPK1
SCHEMBL929527 0.93 TSHR (0.36) TSHRHTR2AHTR2CHTR2BMAPK1
SCHEMBL14922866 0.93 TSHR (0.36) TSHRHTR2AHTR2CHTR2BMAPK1
SCHEMBL15428812 0.93 TSHR (0.36) TSHRHTR2AHTR2CHTR2BMAPK1
SCHEMBL14394512 0.79 TSHR (0.32) TSHROPRK1POLBRXFP1
SCHEMBL1013730 0.77 HTR2C (0.38) HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL1017059 0.75 HTR2C (0.37) HTR2AHTR2CHTR2B
SCHEMBL1586120 0.73 DRD1 (0.48) TSHRDRD1MAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260092053-A1 KHK INHIBITORS GILEAD SCIENCES INC (US) 2026-04-02 US disclosed
EP-4681774-A2 KHK INHIBITORS Gilead Sciences, Inc. (US) 2026-01-21 EP disclosed
EP-4313967-B1 KHK INHIBITORS GILEAD SCIENCES INC (US) 2025-11-12 EP disclosed
US-12410160-B2 KHK inhibitors GILEAD SCIENCES, INC. (US) 2025-09-09 US disclosed
US-20250152588-A1 HYDROXYLATED AND METHOXYLATED PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2025-05-15 US disclosed
CN-118239926-A TLR7 and 8 inhibitors, preparation method and application thereof 上海深势唯思科技有限责任公司 2024-06-25 CN disclosed
US-20240150293-A1 SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS VERNALIS (R&D) LTD (GB) 2024-05-09 US disclosed
EP-4313967-A1 KHK INHIBITORS GILEAD SCIENCES, INC. (US) 2024-02-07 EP disclosed
CN-117120429-A KHK inhibitor 吉利德科学公司 2023-11-24 CN disclosed
EP-4277892-A1 SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS Les Laboratoires Servier (FR) 2023-11-22 EP disclosed
US-5610303-A MONOAMIDE OXIDASE INHIBITORS UBE INDUSTRIES, LTD. (JP) 1997-03-11 US disclosed
EP-0664291-A1 PYRIMIDINE COMPOUND UBE INDUSTRIES, LTD. (JP) 1995-07-26 EP disclosed
EP-0194161-B1 Cyclopenta[d]pyrimidine derivatives, their preparation and use SANKYO CO (JP) 1994-05-25 EP disclosed
US-4749704-A Cyclopenta[d]pyrimidine derivatives and use as antidepressants SANKYO COMPANY LIMITED (JP) 1988-06-07 US disclosed
EP-0194161-A2 Cyclopenta[d]pyrimidine derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1986-09-10 EP disclosed
EP-0067630-B1 PYRIMIDINE DERIVATIVES, A PROCESS FOR PREPARING THEM AND A PHARMACEUTICAL COMPOSITION CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1985-05-08 EP disclosed
US-4450162-A Pyrimidine derivatives and a pharmaceutical composition containing them SANKYO COMPANY, LIMITED (JP) 1984-05-22 US disclosed
US-4435402-A Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY, LIMITED (JP) 1984-03-06 US disclosed
EP-0067630-A1 Pyrimidine derivatives, a process for preparing them and a pharmaceutical composition containing them SANKYO COMPANY LIMITED (JP) 1982-12-22 EP disclosed
EP-0057440-A1 Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY LIMITED (JP) 1982-08-11 EP 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 (4 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-20240150293-A1 SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS BCL2, BAX, BCL2A1 TSHR 2897/4885DRD1 3039/4885HTR2A 2445/4885
US-20260092053-A1 KHK INHIBITORS KHK, SLC5A2, HK1 TSHR 2641/4885DRD1 2047/4885HTR2A 1602/4885
US-12410160-B2 KHK inhibitors KHK, KHDRBS1, NADK TSHR 3789/4885DRD1 4634/4885HTR2A 2802/4885
US-20250152588-A1 HYDROXYLATED AND METHOXYLATED PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT1S1 TSHR 4108/4885DRD1 3853/4885HTR2A 1733/4885

“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.