SCHEMBL19405034

SCHEMBL19405034

COC1CCN(c2ccc3c4c(cccc24)C(=O)N(c2cc(N(C)C)c(N(C)C=O)cc2C)C3=O)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD1 O95696 12/20 0.67
▸ BRPF1 P55201 12/20 0.67
▸ TAF1 P21675 11/20 0.67
▸ BRD4 O60885 2/20 0.51
▸ MEN1 O00255 8/20 0.41
▸ KMT2A Q03164 8/20 0.41
▸ USP2 O75604 5/20 0.41
▸ LMNA P02545 3/20 0.41
▸ CASP1 P29466 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ CASP7 P55210 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ HTT P42858 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ L3MBTL1 Q9Y468 3/20 0.40
▸ TLR9 Q9NR96 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ TNNI3 P19429 1/20 0.39
▸ TNNT2 P45379 1/20 0.39
▸ TNNC1 P63316 1/20 0.39

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
SCHEMBL19404621 0.84 BRD1 (0.52) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19405036 0.81 BRD1 (1.00) BRD1BRPF1TAF1BRD4
SCHEMBL19405033 0.78 BRD1 (0.77) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404480 0.73 BRD1 (0.49) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404607 0.73 BRD1 (0.45) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404612 0.72 BRD1 (0.39) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404816 0.71 BRD1 (0.61) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404457 0.69 BRD1 (1.00) BRD1BRPF1TAF1BRD4
SCHEMBL19405041 0.68 BRD1 (0.67) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19405037 0.68 BRD1 (1.00) BRD1BRPF1TAF1BRD4MEN1

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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