SCHEMBL7014696

SCHEMBL7014696

CCC(C)N1CCOc2c1cc(C)nc2Nc1c(C)cc(C)cc1C

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.35
L3MBTL1 Q9Y468 1/20 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
SCHEMBL7015440 0.92 CRHR1 (0.41) CRHR1
SCHEMBL7013470 0.80 L3MBTL1 (0.36) CRHR1L3MBTL1
SCHEMBL7016490 0.78 CRHR1 (0.44) CRHR1
SCHEMBL7009568 0.78 L3MBTL1 (0.33) CRHR1L3MBTL1
SCHEMBL7016559 0.78 CRHR1 (0.35) CRHR1L3MBTL1
SCHEMBL7019267 0.71 CRHR1 (0.40) CRHR1
SCHEMBL7021259 0.70 CRHR1 (0.46) CRHR1
SCHEMBL7018430 0.70 CRHR1 (0.41) CRHR1
SCHEMBL7013557 0.70 CRHR1 (0.39) CRHR1
SCHEMBL7013733 0.69 CRHR1 (0.40) 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 4 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
US-6492520-B1 COMPOUNDS (I) ARE CORTICOTROPIN RELEASING FACTOR (HORMONE) CRF (CRH) ANTAGONISTS. PFIZER INC 2002-12-10 US 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