SCHEMBL19931013

SCHEMBL19931013

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.37
CREBBP Q92793 1/20 0.37
DHFR P00374 1/20 0.36
BRD9 Q9H8M2 6/20 0.35
BRD4 O60885 5/20 0.35
PDE10A Q9Y233 2/20 0.35
BRD7 Q9NPI1 2/20 0.34
BRD2 P25440 1/20 0.34
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR3 P22607 1/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL19930933 0.94 PDE4B (0.36) PDE4BCREBBPBRD9BRD4PDE10A
SCHEMBL19930761 0.85 BRD4 (0.39) CREBBPBRD9BRD4
SCHEMBL16651731 0.82 BRD4 (0.46) PDE4BCREBBPBRD9BRD4PDE10A
SCHEMBL19930818 0.81 CREBBP (0.35) CREBBPDHFRBRD9BRD4PDE10A
SCHEMBL16865625 0.80 CREBBP (0.35) CREBBPBRD9BRD4PDE10ABRD7
SCHEMBL25043154 0.79 CREBBP (0.40) CREBBPBRD4FGFR1KDM4EALDH1A1
SCHEMBL16651444 0.79 CREBBP (0.38) CREBBPBRD4PDE10AHPGDHSD17B10
SCHEMBL19930969 0.79 BRD4 (0.38) CREBBPBRD9BRD4
SCHEMBL29848786 0.76 BRD4 (0.44) PDE4BCREBBPBRD9BRD4PDE10A
SCHEMBL16651614 0.76 BRD4 (0.44) PDE4BCREBBPBRD9BRD4PDE10A

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