SCHEMBL23073006

SCHEMBL23073006

CCSNc1cc(-c2cc(C)c(=O)n(C)c2)cc2c1ncn2Cc1cccc(F)c1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.50
GRIN1 Q05586 2/20 0.40
GRIN2B Q13224 2/20 0.40

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
SCHEMBL23073125 0.92 BRD4 (0.52) BRD4GRIN1GRIN2B
SCHEMBL23073011 0.87 BRD4 (0.42) BRD4
SCHEMBL18152753 0.87 BRD4 (0.54) BRD4
SCHEMBL18152849 0.86 BRD4 (0.51) BRD4GRIN1GRIN2B
SCHEMBL23473063 0.85 BRD4 (0.49) BRD4GRIN1GRIN2B
SCHEMBL18164245 0.85 BRD4 (0.49) BRD4GRIN1GRIN2B
SCHEMBL23073127 0.85 BRD4 (0.50) BRD4GRIN1GRIN2B
SCHEMBL23072985 0.85 BRD4 (0.47) BRD4GRIN1GRIN2B
SCHEMBL18528940 0.84 BRD4 (0.55) BRD4
SCHEMBL23473023 0.82 BRD4 (0.63) BRD4

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
EP-3831383-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2021-06-09 EP disclosed
EP-3283077-B1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2021-03-10 EP disclosed