SCHEMBL7707751

SCHEMBL7707751

CCCN(CCC)c1cc(C)nc2c(-c3ccc(Cl)cc3Cl)cncc12

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.73

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
SCHEMBL6722252 0.85 CRHR1 (1.00) CRHR1
SCHEMBL6340859 0.78 CRHR1 (0.56) CRHR1
SCHEMBL7081441 0.77 CRHR1 (0.64) CRHR1
SCHEMBL6831521 0.74 CRHR1 (1.00) CRHR1
SCHEMBL6345575 0.71 CRHR1 (0.41) CRHR1
SCHEMBL6345576 0.71 CRHR1 (0.41) CRHR1
SCHEMBL6726554 0.68 CRHR1 (1.00) CRHR1
SCHEMBL6355551 0.67 CRHR1 (0.50) CRHR1
SCHEMBL5246749 0.66 CRHR1 (1.00) CRHR1
SCHEMBL21185109 0.66 CRHR1 (0.50) 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-6352990-B1 A METHOD OF TREATING ANXIETY AND DEPRESSION IN A WARM-BLOODED ANIMAL AND TREATMENT OF STROKES BRISTOL-MYERS SQUIBB COMPANY 2002-03-05 US disclosed