SCHEMBL6795930

SCHEMBL6795930

CCC(Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)OC)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.44

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
SCHEMBL5844009 0.93 CRHR1 (0.43) CRHR1
SCHEMBL6793450 0.93 CRHR1 (0.43) CRHR1
SCHEMBL6799331 0.92 CRHR1 (0.43) CRHR1
SCHEMBL6801679 0.91 CRHR1 (0.42) CRHR1
SCHEMBL6804329 0.90 CRHR1 (0.41) CRHR1
SCHEMBL5844156 0.89 CRHR1 (0.57) CRHR1
SCHEMBL6393420 0.88 CRHR1 (0.45) CRHR1
SCHEMBL6796398 0.87 CRHR1 (0.39) CRHR1
SCHEMBL5844732 0.87 CRHR1 (0.51) CRHR1
SCHEMBL5845326 0.87 CRHR1 (0.43) 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
US-6833378-B2 Pyridines, pyrimidines, purinones, pyrrolopyrimidinones and pyrrolopyridinones; useful in the treatment disorders including CNS and stress-related disorders. PFIZER INC 2004-12-21 US disclosed