SCHEMBL16758351

SCHEMBL16758351

COc1ccc(NS(=O)(=O)c2cc(-c3c(C)noc3C)ccc2C)cc1OC

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 19/20 0.77
BRD2 P25440 17/20 0.77
BRD3 Q15059 17/20 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
SCHEMBL14757093 0.83 BRD4 (0.72) BRD4BRD2BRD3
SCHEMBL14757248 0.80 BRD4 (0.74) BRD4BRD2BRD3
SCHEMBL15968112 0.78 BRD4 (0.81) BRD4BRD2BRD3
SCHEMBL15980799 0.78 BRD4 (0.76) BRD4BRD2BRD3
SCHEMBL14757312 0.77 BRD4 (0.73) BRD4BRD2BRD3
SCHEMBL16758412 0.76 BRD4 (0.69) BRD4BRD2BRD3
SCHEMBL28607385 0.76 BRD4 (0.69) BRD4BRD2BRD3
SCHEMBL14740758 0.75 BRD4 (1.00) BRD4BRD2BRD3
SCHEMBL14756139 0.75 BRD4 (0.71) BRD4BRD2BRD3
SCHEMBL16771417 0.74 BRD4 (1.00) BRD4BRD2BRD3

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
WO-2015081280-A1 BROMODOMAIN LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION COFERON, INC. (US) 2015-06-04 WO disclosed
WO-2015081280-A1 BROMODOMAIN LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION COFERON, INC. (US) 2015-06-04 WO disclosed