SCHEMBL7339348

SCHEMBL7339348

Cc1cc(NC(=O)c2cc(F)ccc2Cl)ccc1C(=O)N1Cc2cccn2Cc2ccccc21

nearest known ligand 0.86

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 15/20 0.86
AVPR1A P37288 15/20 0.86
OXTR P30559 1/20 0.82

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
SCHEMBL7335432 0.92 AVPR2 (1.00) AVPR2AVPR1AOXTR
SCHEMBL7341103 0.92 AVPR2 (0.90) AVPR2AVPR1AOXTR
Lixivaptan SCHEMBL1649340 0.90 AVPR2 (1.00) AVPR2AVPR1AOXTR
Lixivaptan SCHEMBL29387791 0.90 AVPR2 (1.00) AVPR2AVPR1AOXTR
Lixivaptan SCHEMBL29373157 0.90 AVPR2 (1.00) AVPR2AVPR1AOXTR
Lixivaptan SCHEMBL29377065 0.90 AVPR2 (1.00) AVPR2AVPR1AOXTR
SCHEMBL7338291 0.87 AVPR2 (0.86) AVPR2AVPR1AOXTR
SCHEMBL8313381 0.87 AVPR2 (1.00) AVPR2AVPR1AOXTR
SCHEMBL7338085 0.86 AVPR2 (0.84) AVPR2AVPR1AOXTR
SCHEMBL13590881 0.85 AVPR2 (0.86) AVPR2AVPR1AOXTR

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
US-5624923-A UROGENITAL AND CARDIOVASCULAR DISORDERS AMERICAN CYANAMID COMPANY (US) 1997-04-29 US claimed
US-5516774-A TREATING DISEASES CHARACTERIZED BY EXCESS RENAL REABSORPTION OF WATER AMERICAN CYANAMID COMPANY (US) 1996-05-14 US claimed