SCHEMBL19404629

SCHEMBL19404629

Cc1cc2[nH]c(=O)n(C)c2cc1N1C(=O)c2cccc3c(CCCO)ccc(c23)C1=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAF1 P21675 18/20 0.75
▸ BRD1 O95696 18/20 0.75
▸ BRPF1 P55201 18/20 0.75
▸ TAF1L Q8IZX4 1/20 0.75
▸ CREBBP Q92793 1/20 0.75
▸ CECR2 Q9BXF3 1/20 0.75
▸ BRPF3 Q9ULD4 1/20 0.75
▸ BRD4 O60885 3/20 0.46
▸ MEN1 O00255 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CRHBP P24387 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ BRCA1 P38398 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ HBB P68871 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CRHR2 Q13324 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
SCHEMBL19405039 0.90 TAF1 (0.61) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL19404628 0.89 TAF1 (0.59) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL30737021 0.85 BRD1 (1.00) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL29430386 0.85 BRD1 (1.00) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL19404632 0.85 BRD1 (1.00) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL19405049 0.85 TAF1 (0.69) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL19404627 0.85 TAF1 (0.86) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL19405042 0.85 TAF1 (1.00) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL19404847 0.84 TAF1 (0.53) TAF1BRD1BRPF1TAF1LCREBBP
SCHEMBL19404844 0.84 TAF1 (0.57) TAF1BRD1BRPF1TAF1LCREBBP

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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