SCHEMBL19930864

SCHEMBL19930864

CCSNc1ncc(CC)c(-c2cn(C)c(=O)c3ccccc23)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 10/20 0.43
MEN1 O00255 5/20 0.43
USP2 O75604 5/20 0.43
CYP1A2 P05177 5/20 0.43
CASP1 P29466 5/20 0.43
CASP7 P55210 5/20 0.43
KMT2A Q03164 5/20 0.43
CYP3A4 P08684 4/20 0.43
LMNA P02545 4/20 0.43
CYP2D6 P10635 3/20 0.43
CYP2C9 P11712 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HIF1A Q16665 2/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 2/20 0.40
CLK4 Q9HAZ1 2/20 0.40
BRD9 Q9H8M2 2/20 0.37
BRD7 Q9NPI1 2/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL19930783 0.93 MEN1 (0.43) BRD4MEN1USP2CYP1A2CASP1
SCHEMBL25043383 0.91 MEN1 (0.40) BRD4MEN1USP2CYP1A2CASP1
SCHEMBL29848709 0.82 BRD4 (0.52) BRD4MEN1USP2CYP1A2CASP1
SCHEMBL16650239 0.82 BRD4 (0.52) BRD4MEN1USP2CYP1A2CASP1
SCHEMBL19931265 0.81 BRD4 (0.40) BRD4MEN1USP2CYP1A2CASP1
SCHEMBL21915917 0.76 BRD4 (0.39) BRD4BRD9
SCHEMBL16658421 0.76 BRD4 (0.46) BRD4BRD9BRD7BRDT
SCHEMBL29848858 0.75 BRD4 (0.49) BRD4MEN1USP2CYP1A2CASP1
SCHEMBL16650709 0.75 BRD4 (0.49) BRD4MEN1USP2CYP1A2CASP1
SCHEMBL29848848 0.74 BRD4 (0.47) BRD4MEN1USP2CYP1A2CASP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4134364-A2 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2023-02-15 EP disclosed
EP-3640241-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2020-04-22 EP disclosed
EP-3290407-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc (US) 2018-03-07 EP disclosed