SCHEMBL19930818

SCHEMBL19930818

CCCc1cnc(NSCC)nc1-c1cc(OC)c(=O)n(C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.35
BRD4 O60885 9/20 0.34
BRD9 Q9H8M2 7/20 0.33
PDE10A Q9Y233 3/20 0.33
MEN1 O00255 2/20 0.32
USP2 O75604 2/20 0.32
ALDH1A1 P00352 2/20 0.32
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
KMT2A Q03164 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
BRD7 Q9NPI1 3/20 0.32
BRD2 P25440 1/20 0.32
FGFR1 P11362 1/20 0.32
FGFR2 P21802 1/20 0.32

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
SCHEMBL25043154 0.84 CREBBP (0.40) CREBBPBRD4MEN1USP2ALDH1A1
SCHEMBL16651444 0.84 CREBBP (0.38) CREBBPBRD4PDE10AHSD17B10LMNA
SCHEMBL19931013 0.81 PDE4B (0.37) CREBBPBRD4BRD9PDE10AMEN1
SCHEMBL25043398 0.80 BRD4 (0.40) CREBBPBRD4MEN1USP2ALDH1A1
SCHEMBL21915917 0.79 BRD4 (0.39) CREBBPBRD4BRD9
SCHEMBL16651201 0.78 CREBBP (0.37) CREBBPBRD4PDE10AHSD17B10LMNA
SCHEMBL29848696 0.78 CREBBP (0.37) CREBBPBRD4PDE10AHSD17B10LMNA
SCHEMBL16651731 0.78 BRD4 (0.46) CREBBPBRD4BRD9PDE10ABRD7
SCHEMBL16865625 0.77 CREBBP (0.35) CREBBPBRD4BRD9PDE10ABRD7
SCHEMBL19930783 0.76 MEN1 (0.43) BRD4BRD9MEN1USP2ALDH1A1

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