SCHEMBL7015270

SCHEMBL7015270

CCC(CC)N1CC(=O)Nc2c(Nc3c(C)cc(C)cc3C)nc(C)nc21

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 6/20 0.37

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
SCHEMBL7018793 0.83 CRHR1 (0.38) CRHR1
SCHEMBL7014123 0.80 CRHR1 (0.40) CRHR1
SCHEMBL7018802 0.78 CRHR1 (0.37) CRHR1
SCHEMBL809834 0.73 CRHR1 (0.39) CRHR1
SCHEMBL27670949 0.72 CRHR1 (0.38) CRHR1
SCHEMBL7018646 0.71 CRHR1 (0.40) CRHR1
SCHEMBL7011679 0.70 CRHR1 (0.39) CRHR1
SCHEMBL7506309 0.69
SCHEMBL5600364 0.69 CYP1A2 (0.39) CRHR1
SCHEMBL7018430 0.68 CRHR1 (0.41) CRHR1

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-0920429-B1 SUBSTITUTED PYRIDO- OR PYRIMIDO-CONTAINING 6,6- OR 6,7-BICYCLIC DERIVATIVES PFIZER (US) 2003-02-19 EP disclosed
EP-0920429-A1 SUBSTITUTED PYRIDO- OR PYRIMIDO-CONTAINING 6,6- OR 6,7-BICYCLIC DERIVATIVES PFIZER INC. (US) 1999-06-09 EP disclosed
WO-1998005661-A1 SUBSTITUTED PYRIDO- OR PYRIMIDO-CONTAINING 6,6- OR 6,7-BICYCLIC DERIVATIVES PFIZER INC. (US) 1998-02-12 WO disclosed