SCHEMBL19930933

SCHEMBL19930933

CCCCc1cnc(SC)nc1-c1cc(OC)c(=O)n(C)c1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.36
TLR8 Q9NR97 1/20 0.36
CREBBP Q92793 1/20 0.36
BRD9 Q9H8M2 4/20 0.34
BRD4 O60885 3/20 0.34
PDE10A Q9Y233 2/20 0.34
BRD2 P25440 1/20 0.33
BRD7 Q9NPI1 1/20 0.33
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 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
SCHEMBL19931013 0.94 PDE4B (0.37) PDE4BCREBBPBRD9BRD4PDE10A
SCHEMBL19930969 0.86 BRD4 (0.38) CREBBPBRD9BRD4
SCHEMBL16651614 0.82 BRD4 (0.44) PDE4BTLR8CREBBPBRD9BRD4
SCHEMBL29848786 0.82 BRD4 (0.44) PDE4BTLR8CREBBPBRD9BRD4
SCHEMBL16651201 0.80 CREBBP (0.37) PDE4BCREBBPBRD4PDE10A
SCHEMBL29848696 0.80 CREBBP (0.37) PDE4BCREBBPBRD4PDE10A
SCHEMBL19931263 0.79 BRD4 (0.39) CREBBPBRD4ADORA2A
SCHEMBL19930761 0.79 BRD4 (0.39) CREBBPBRD9BRD4
SCHEMBL25043154 0.78 CREBBP (0.40) CREBBPBRD4
SCHEMBL16651731 0.76 BRD4 (0.46) 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