SCHEMBL19404590

SCHEMBL19404590

CN(C)c1cc2[nH]c(=O)n(C)c2cc1N1C(=O)c2cccc3c(Cl)ccc(c23)C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAF1 P21675 9/20 0.57
▸ BRD1 O95696 9/20 0.57
▸ BRPF1 P55201 9/20 0.57
▸ KDM4E B2RXH2 3/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ HPGD P15428 1/20 0.54
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ POLB P06746 2/20 0.49
▸ USP2 O75604 1/20 0.43
▸ LMNA P02545 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ ERCC1 P07992 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ FEN1 P39748 1/20 0.43
▸ ERCC4 Q92889 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ BRD4 O60885 2/20 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
SCHEMBL19405013 0.89 TAF1 (0.61) TAF1BRD1BRPF1KDM4EALDH1A1
SCHEMBL19404591 0.88 BRD1 (0.71) TAF1BRD1BRPF1KDM4EALDH1A1
SCHEMBL19404421 0.86 BRD1 (0.69) TAF1BRD1BRPF1KMT2AMEN1
SCHEMBL19404592 0.84 BRD1 (0.76) TAF1BRD1BRPF1KDM4EALDH1A1
SCHEMBL19405012 0.81 KDM4E (0.59) TAF1BRD1BRPF1KDM4EALDH1A1
SCHEMBL19404507 0.80 TAF1 (0.58) TAF1BRD1BRPF1KDM4EALDH1A1
SCHEMBL19404437 0.78 BRD1 (0.59) TAF1BRD1BRPF1KMT2AMEN1
SCHEMBL19404424 0.77 MEN1 (0.54) TAF1BRD1BRPF1KMT2AMEN1
SCHEMBL19404618 0.77 MEN1 (0.60) TAF1BRD1BRPF1KDM4EALDH1A1
SCHEMBL19404588 0.77 BRD1 (0.59) TAF1BRD1BRPF1KDM4EKMT2A

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-2017162661-A1 1H-BENZO[DE]ISOQUINOLINE-1,3(2H)-DIONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-09-28 — — WO disclosed
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