SCHEMBL18171131

SCHEMBL18171131

N#Cc1ccc(NC(=O)c2c(-c3ccc(Cl)c(Cl)c3)nn3c2CN(C(N)=O)C(C(F)(F)F)C3)cc1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 16/20 0.71
▸ CSNK1D P48730 14/20 0.71
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 1/20 0.38
▸ TAS1R2 Q8TE23 1/20 0.38
▸ TRPV1 Q8NER1 1/20 0.35
▸ RIPK2 O43353 1/20 0.34
▸ ACR P10323 1/20 0.34

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
SCHEMBL18184045 0.89 CSNK1E (0.88) CSNK1ECSNK1D
SCHEMBL18171175 0.88 CSNK1E (0.57) CSNK1ECSNK1DTAS1R3TAS1R1TAS1R2
SCHEMBL16728859 0.84 CSNK1E (0.73) CSNK1ECSNK1D
SCHEMBL18171164 0.83 CSNK1E (1.00) CSNK1ECSNK1D
SCHEMBL16722553 0.81 CSNK1E (0.65) CSNK1ECSNK1DTAS1R3TAS1R1TAS1R2
SCHEMBL16722730 0.79 CSNK1E (0.82) CSNK1ECSNK1D
SCHEMBL18184044 0.78 CSNK1E (0.69) CSNK1ECSNK1DRIPK2
SCHEMBL16722740 0.78 CSNK1E (0.52) CSNK1ECSNK1DTAS1R3TAS1R1TAS1R2
SCHEMBL18171259 0.78 CSNK1E (0.63) CSNK1ECSNK1DTAS1R3TAS1R1TAS1R2
SCHEMBL16700761 0.77 CSNK1E (0.62) CSNK1ECSNK1DTAS1R3TAS1R1TAS1R2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068784-B1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-02-20 — — EP disclosed
US-9598423-B2 Substituted 4,5,6,7-tetrahydropyrazolo[1,5-A]pyrazine derivatives as casein kinase 1 D/E inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-03-21 — — US disclosed
US-20160311824-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-10-27 — — 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 (1 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-20160311824-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS CSNK1A1, CSNK1E, CSNK1G1 CSNK1E 2/4885CSNK1D 6/4885TAS1R3 3392/4885

“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.

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