SCHEMBL14723592

SCHEMBL14723592

CN1Cc2cc(NS(=O)(=O)c3cccc(C#N)c3)ccc2NC1=O

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 19/20 0.79
CREBBP Q92793 1/20 0.57
BRD1 O95696 1/20 0.55
BRPF1 P55201 1/20 0.55

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
SCHEMBL14723348 0.88 BRD4 (1.00) BRD4CREBBP
SCHEMBL14723089 0.85 BRD4 (0.79) BRD4CREBBP
SCHEMBL14721322 0.85 BRD4 (0.79) BRD4CREBBP
SCHEMBL14723566 0.84 BRD4 (0.77) BRD4CREBBP
SCHEMBL14722707 0.84 BRD4 (0.77) BRD4CREBBP
SCHEMBL14722491 0.82 BRD4 (1.00) BRD4CREBBP
SCHEMBL14722705 0.81 BRD4 (0.72) BRD4CREBBP
SCHEMBL14721092 0.79 BRD4 (1.00) BRD4CREBBP
SCHEMBL16760651 0.79 BRD4 (0.82) BRD4CREBBP
SCHEMBL16771882 0.78 BRD4 (0.87) BRD4CREBBP

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-2013027168-A1 NOVEL HETEROCYCLIC COMPOUNDS AS BROMODOMAIN INHIBITORS PFIZER INC. (US) 2013-02-28 WO disclosed