SCHEMBL21658287

SCHEMBL21658287

CCSc1ccc(N2CCC3(CC3)C2)c(-c2cn(C)c(=O)c3[nH]ccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.53
BRD2 P25440 1/20 0.40

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
SCHEMBL23470892 0.91 BRD4 (0.52) BRD4
SCHEMBL20384573 0.86 BRD4 (0.68) BRD4BRD2
SCHEMBL23377357 0.84 BRD4 (0.52) BRD4
SCHEMBL21658286 0.84 BRD4 (0.76) BRD4
SCHEMBL23470657 0.83 BRD4 (0.52) BRD4
SCHEMBL23470774 0.81 BRD4 (0.49) BRD4
SCHEMBL21658091 0.81 BRD4 (0.62) BRD4
SCHEMBL21658095 0.81 BRD4 (0.52) BRD4
SCHEMBL23377580 0.81 BRD4 (0.57) BRD4
SCHEMBL23377377 0.81 BRD4 (0.59) BRD4BRD2

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-3831828-A1 BRD4 INHIBITOR, PREPARATION METHOD AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-06-09 EP disclosed
WO-2020020308-A1 BRD4 INHIBITOR, PREPARATION METHOD AND USE THEREOF 成都海创药业有限公司 2020-01-30 WO disclosed