SCHEMBL20159924

SCHEMBL20159924

CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)c(-c2cc(NC(=O)OC(C)C)c3nnc(C)n3n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 2/20 0.46
BRD4 O60885 19/20 0.45
EP300 Q09472 2/20 0.44
BRD2 P25440 2/20 0.42
BRDT Q58F21 2/20 0.42
TRIM24 O15164 1/20 0.42
BRD1 O95696 1/20 0.42
TAF1 P21675 1/20 0.42
SMARCA4 P51532 1/20 0.42
BPTF Q12830 1/20 0.42
ATAD2 Q6PL18 1/20 0.42
PBRM1 Q86U86 1/20 0.42
TAF1L Q8IZX4 1/20 0.42
CREBBP Q92793 1/20 0.42
KAT2B Q92831 1/20 0.42
CECR2 Q9BXF3 1/20 0.42
BRD9 Q9H8M2 1/20 0.42
BRD7 Q9NPI1 1/20 0.42
BAZ2A Q9UIF9 1/20 0.42
BRPF3 Q9ULD4 1/20 0.42

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
SCHEMBL20159868 0.90 BRD9 (0.51) BRPF1BRD4EP300BRD2BRDT
SCHEMBL20160107 0.88 BRD4 (0.48) BRPF1BRD4EP300BRD2BRDT
SCHEMBL20160320 0.88 BRPF1 (0.41) BRPF1BRD4BRD2BRDTTRIM24
SCHEMBL20160303 0.86 BRD4 (0.58) BRD4EP300BRD2BRDTADORA2B
SCHEMBL20159916 0.85 BRD9 (0.41) BRPF1BRD4BRD2BRDTTRIM24
SCHEMBL20160053 0.84 BRD4 (0.53) BRD4EP300BRD2BRDTADORA2B
SCHEMBL20159872 0.83 BRD4 (0.51) BRD4EP300BRD2BRDTADORA2B
SCHEMBL20159914 0.83 BRD4 (0.49) BRD4EP300BRD2BRDTADORA2B
SCHEMBL20159846 0.83 BRD4 (0.51) BRD4EP300BRD2BRDTADORA2B
SCHEMBL20159926 0.83 BRPF1 (0.55) BRPF1BRD4EP300BRD2BRDT

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