SCHEMBL8313847

SCHEMBL8313847

Cc1ccc(C(=O)Nc2ccc(C(=O)N3Cc4ccc(Cl)n4Cc4ccccc43)cc2)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 10/20 0.62
AVPR1A P37288 8/20 0.62

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
SCHEMBL8315753 0.94 AVPR2 (0.56) AVPR2AVPR1A
SCHEMBL8316848 0.91 AVPR2 (0.74) AVPR2AVPR1A
SCHEMBL8317926 0.89 AVPR2 (0.61) AVPR2AVPR1A
SCHEMBL8316071 0.88 AVPR2 (0.63) AVPR2AVPR1A
SCHEMBL7333390 0.87 AVPR2 (0.62) AVPR2AVPR1A
SCHEMBL8316548 0.86 AVPR2 (0.56) AVPR2AVPR1A
SCHEMBL8315841 0.85 AVPR2 (0.64) AVPR2AVPR1A
SCHEMBL8314412 0.85 AVPR2 (0.54) AVPR2AVPR1A
SCHEMBL8316666 0.85 AVPR2 (0.59) AVPR2AVPR1A
SCHEMBL8316520 0.85 AVPR2 (0.52) AVPR2AVPR1A

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-0636625-B1 Tricyclic diazepines vasopressin and oxytocin antagonists AMERICAN CYANAMID CO (US) 1999-01-27 EP disclosed