SCHEMBL8347791

SCHEMBL8347791

COCC1Cc2ccccc2CN1Cc1c(SC)nn(-c2c(Cl)cc(Cl)cc2Cl)c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 8/20 0.36
▸ CCND1 P24385 8/20 0.36
▸ CCNE2 O96020 7/20 0.36
▸ CCNE1 P24864 7/20 0.36
▸ CDK2 P24941 7/20 0.36
▸ BCL2 P10415 1/20 0.36
▸ BAD Q92934 1/20 0.36
▸ OPRM1 P35372 1/20 0.34
▸ OPRD1 P41143 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ CRHR1 P34998 1/20 0.34
▸ GABRP O00591 6/20 0.33
▸ GABRD O14764 6/20 0.33
▸ GABRA1 P14867 6/20 0.33
▸ GABRB1 P18505 6/20 0.33
▸ GABRG2 P18507 6/20 0.33
▸ GABRB3 P28472 6/20 0.33
▸ GABRA5 P31644 6/20 0.33
▸ GABRA3 P34903 6/20 0.33
▸ GABRA2 P47869 6/20 0.33

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
SCHEMBL8350166 1.00 CDK4 (0.36) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8351551 0.91 GABRP (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8505897 0.89 CCNE2 (0.37) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL7608894 0.89 BCL2 (0.36) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8329192 0.86 BCL2 (0.36) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8327392 0.86 BCL2 (0.36) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8330780 0.81 CCNE2 (0.38) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8783898 0.80 CDK4 (0.33) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8506845 0.80 GABRP (0.44) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8782500 0.79 CCNE2 (0.32) CDK4CCND1CCNE2CCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0674631-B1 SUBSTITUTED PYRAZOLES AS CRF ANTAGONISTS PFIZER (US) 1999-12-08 — — EP claimed
EP-0959074-A2 Substituted pyrazoles as CRF antagonists PFIZER INC. (US) 1999-11-24 — — EP claimed
US-5705646-A Substituted pyrazoles as CRF antagonists PFIZER INC. (US) 1998-01-06 — — US claimed
EP-0674631-A1 SUBSTITUTED PYRAZOLES AS CRF ANTAGONISTS PFIZER INC. (US) 1995-10-04 — — EP claimed
WO-1994013661-A1 SUBSTITUTED PYRAZOLES AS CRF ANTAGONISTS PFIZER INC. (US) 1994-06-23 — — WO claimed
EP-0959074-A2 Substituted pyrazoles as CRF antagonists PFIZER INC. (US) 1999-11-24 — — EP disclosed
US-5958948-A CORTICOTROPIN RELEASING FACTOR; THERAPY FOR STRESS PFIZER, INC. (US) 1999-09-28 — — US disclosed
US-5705646-A Substituted pyrazoles as CRF antagonists PFIZER INC. (US) 1998-01-06 — — US disclosed
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