SCHEMBL20159927

SCHEMBL20159927

CCSNc1cnc(Oc2ccc(F)cc2F)c(-c2cc(NC)c3nnc(C)n3n2)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 18/20 0.43
BRPF1 P55201 1/20 0.33
MAPK14 Q16539 1/20 0.33
BRD2 P25440 1/20 0.32
EP300 Q09472 1/20 0.32
BRD3 Q15059 1/20 0.32
BRDT Q58F21 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
SCHEMBL20160106 0.78 BRPF1 (0.39) BRD4BRPF1BRD2BRDT
SCHEMBL20160050 0.76 BRD4 (0.46) BRD4BRPF1MAPK14BRD2BRD3
SCHEMBL20159926 0.76 BRPF1 (0.55) BRD4BRPF1BRD2EP300BRDT
SCHEMBL20160243 0.75 BRPF1 (0.51) BRD4BRPF1BRD2BRDT
SCHEMBL20160319 0.71 BRD4 (0.40) BRD4BRD2EP300BRD3BRDT
SCHEMBL20160303 0.70 BRD4 (0.58) BRD4BRD2EP300BRD3BRDT
SCHEMBL20159914 0.69 BRD4 (0.49) BRD4BRD2EP300BRD3BRDT
SCHEMBL20160005 0.69 BRD4 (0.39) BRD4BRD2EP300BRD3BRDT
SCHEMBL20159923 0.68 BRD4 (0.39) BRD4BRPF1
SCHEMBL20160324 0.68 BRD4 (0.44) BRD4BRD2EP300BRD3BRDT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018086585-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF 山东罗欣药业集团股份有限公司 2018-05-17 WO disclosed