SCHEMBL18617017

SCHEMBL18617017

CNC(=O)c1cc(C=O)cn(Cc2cccc(C=O)c2)c1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 19/20 0.58
▸ BRD2 P25440 2/20 0.50
▸ BRD3 Q15059 2/20 0.50
▸ BRDT Q58F21 2/20 0.50
▸ TRIM24 O15164 1/20 0.50
▸ BRD1 O95696 1/20 0.50
▸ CCL2 P13500 1/20 0.50
▸ TAF1 P21675 1/20 0.50
▸ SMARCA2 P51531 1/20 0.50
▸ SMARCA4 P51532 1/20 0.50
▸ BRPF1 P55201 1/20 0.50
▸ EP300 Q09472 1/20 0.50
▸ BPTF Q12830 1/20 0.50
▸ CACNA1C Q13936 1/20 0.50
▸ ATAD2 Q6PL18 1/20 0.50
▸ PBRM1 Q86U86 1/20 0.50
▸ TAF1L Q8IZX4 1/20 0.50
▸ CREBBP Q92793 1/20 0.50
▸ KAT2A Q92830 1/20 0.50
▸ KAT2B Q92831 1/20 0.50

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
SCHEMBL18617152 0.91 BRD4 (0.56) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18616079 0.90 BRD4 (0.71) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18584622 0.83 BRD4 (0.77) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18689499 0.83 BRD4 (0.62) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18617057 0.83 BRD4 (0.79) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18616184 0.82 BRD4 (0.48) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18617830 0.82 BRD4 (0.49) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18617248 0.81 BRD4 (0.62) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18617903 0.80 BRD4 (0.47) BRD4BRD2BRD3BRDTTRIM24
SCHEMBL18617910 0.80 BRD4 (0.46) BRD4BRD2BRD3BRDTTRIM24

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-2017037116-A1 PYRIDINONE DICARBOXAMIDE FOR USE AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-03-09 — — WO disclosed
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