SCHEMBL8313271

SCHEMBL8313271

Cc1c(F)cccc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 4/20 0.77
AVPR1A P37288 4/20 0.77

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
SCHEMBL7335347 0.92 AVPR2 (0.74) AVPR2AVPR1A
SCHEMBL7340480 0.91 AVPR2 (0.70) AVPR2AVPR1A
SCHEMBL7331689 0.91 AVPR2 (0.76) AVPR2AVPR1A
SCHEMBL7331296 0.88 AVPR2 (0.80) AVPR2AVPR1A
SCHEMBL7332865 0.87 AVPR2 (1.00) AVPR2AVPR1A
SCHEMBL8317809 0.86 AVPR2 (0.77) AVPR2AVPR1A
SCHEMBL7331956 0.86 AVPR2 (0.58) AVPR2AVPR1A
SCHEMBL8316581 0.85 AVPR2 (0.71) AVPR2AVPR1A
SCHEMBL8317833 0.85 AVPR2 (0.72) AVPR2AVPR1A
SCHEMBL7335324 0.85 AVPR2 (1.00) 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