SCHEMBL7464292

SCHEMBL7464292

CCC(CC)n1nnc2c(N3CCCc4cc(Cl)cc(C)c43)nc(C)cc21

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 13/20 0.76

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
SCHEMBL7469315 0.93 CRHR1 (0.66) CRHR1
SCHEMBL7479325 0.89 CRHR1 (0.61) CRHR1
SCHEMBL7476985 0.89 CRHR1 (0.62) CRHR1
SCHEMBL7473172 0.87 CRHR1 (0.59) CRHR1
SCHEMBL7217181 0.86 CRHR1 (0.76) CRHR1
SCHEMBL7224264 0.86 CRHR1 (1.00) CRHR1
SCHEMBL7217549 0.83 CRHR1 (0.62) CRHR1
SCHEMBL7478592 0.82 CRHR1 (0.54) CRHR1
SCHEMBL7464456 0.81 CRHR1 (0.52) CRHR1
SCHEMBL7224230 0.80 CRHR1 (0.85) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1012151-B1 HETEROCYCLYL-SUBSTITUTED RING-FUSED PYRIDINES AND PYRIMIDINES AS CORTICOTROPIN RELEASING HORMONE (CRH) ANTAGONISTS, USEFUL FOR TREATING CNS AND STRESS-RELATED DISORDERS BRISTOL MYERS SQUIBB PHARMA CO (US) 2002-08-07 EP claimed