SCHEMBL7336291

SCHEMBL7336291

O=C(Nc1ccc(C(=O)N2Cc3ccccc3Cc3ccccc32)c(Cl)c1)c1ccccc1-c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 19/20 0.73
AVPR1A P37288 9/20 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
SCHEMBL7339535 0.89 AVPR2 (0.63) AVPR2AVPR1A
SCHEMBL8557043 0.86 AVPR2 (0.72) AVPR2AVPR1A
SCHEMBL8559486 0.86 AVPR2 (0.71) AVPR2AVPR1A
SCHEMBL7335725 0.86 AVPR2 (0.67) AVPR2AVPR1A
SCHEMBL7332478 0.86 AVPR2 (0.67) AVPR2AVPR1A
SCHEMBL7369344 0.85 AVPR2 (0.70) AVPR2AVPR1A
SCHEMBL5738817 0.84 AVPR2 (1.00) AVPR2AVPR1A
SCHEMBL6997469 0.83 AVPR2 (1.00) AVPR2AVPR1A
SCHEMBL5738936 0.83 AVPR2 (0.76) AVPR2AVPR1A
SCHEMBL8563435 0.82 AVPR2 (0.74) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996022282-A1 TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS AMERICAN CYANAMID COMPANY (US) 1996-07-25 WO claimed
WO-1996022282-A1 TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS AMERICAN CYANAMID COMPANY (US) 1996-07-25 WO disclosed