SCHEMBL7397457

SCHEMBL7397457

Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3ccccc3Oc3ncccc32)cn1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.48
AVPR2 P30518 2/20 0.48
AVPR1A P37288 2/20 0.48
SHMT2 P34897 1/20 0.46

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
SCHEMBL7335243 0.94 AVPR2 (0.48) AVPR2AVPR1A
SCHEMBL7339651 0.91 AVPR2 (0.51) AVPR2AVPR1A
SCHEMBL7333346 0.86 LMNA (0.44) LMNATP53
SCHEMBL7344491 0.86 TP53 (0.40) TP53SHMT2
SCHEMBL7334278 0.84 AVPR2 (0.43) AVPR2AVPR1A
SCHEMBL7343236 0.84 AVPR2 (0.45) AVPR2AVPR1A
SCHEMBL7368892 0.83 AVPR2 (0.56) AVPR2AVPR1A
SCHEMBL7334645 0.83 AVPR2 (0.49) AVPR2AVPR1A
SCHEMBL7334184 0.82 TP53 (0.47) TP53AVPR2AVPR1ASHMT2
SCHEMBL5739209 0.81 AVPR2 (0.59) 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
WO-1996022282-A1 TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS AMERICAN CYANAMID COMPANY (US) 1996-07-25 WO claimed