SCHEMBL18152740

SCHEMBL18152740

CN1CCOc2ccc(-c3cn(C)c(=O)c4ccccc34)cc21

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 19/20 0.64
▸ BRD9 Q9H8M2 1/20 0.50
▸ BRD7 Q9NPI1 1/20 0.50
▸ BRDT Q58F21 1/20 0.47

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
SCHEMBL18152902 0.81 BRD4 (0.57) BRD4BRD9BRD7BRDT
SCHEMBL29848735 0.78 BRD4 (1.00) BRD4BRD9BRD7
SCHEMBL16651293 0.78 BRD4 (1.00) BRD4BRD9BRD7
SCHEMBL6334276 0.70 BRD4 (1.00) BRD4BRD9BRD7BRDT
SCHEMBL14158616 0.68 CYP11B1 (0.39) BRD4
SCHEMBL25043198 0.68 BRD4 (0.62) BRD4BRD9BRD7BRDT
SCHEMBL17029239 0.68 BRD9 (0.77) BRD4BRD9BRD7BRDT
SCHEMBL19857684 0.68 BRD4 (0.72) BRD4BRD9BRD7BRDT
SCHEMBL29613205 0.68 BRD4 (0.72) BRD4BRD9BRD7BRDT
SCHEMBL519320 0.68 NOTUM (0.56) —

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
EP-3283077-A2 BROMODOMAIN INHIBITOR Celgene Quanticel Research, Inc. (US) 2018-02-21 — — EP disclosed
WO-2016168682-A2 BROMODOMAIN INHIBITOR CELGENE QUANTICEL RESEARCH, INC. (US) 2016-10-20 — — WO disclosed
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