SCHEMBL19404460

SCHEMBL19404460

CCCNc1ccc2c3c(cccc13)C(=O)N(c1cc3c(cc1C)[nH]c(=O)n3C)C2=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD1 O95696 13/20 0.75
▸ BRPF1 P55201 13/20 0.75
▸ TAF1 P21675 13/20 0.75
▸ MEN1 O00255 1/20 0.48
▸ RGS12 O14924 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ATM Q13315 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ TLR9 Q9NR96 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC6 Q9UBN7 2/20 0.46
▸ BRD4 O60885 3/20 0.46
▸ TAF1L Q8IZX4 1/20 0.45

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
SCHEMBL19404464 0.85 BRD1 (1.00) BRD1BRPF1TAF1MEN1RGS12
SCHEMBL19404830 0.81 TAF1 (0.51) BRD1BRPF1TAF1MEN1USP2
SCHEMBL19404591 0.81 BRD1 (0.71) BRD1BRPF1TAF1POLBMAPT
SCHEMBL19404528 0.81 BRD1 (0.71) BRD1BRPF1TAF1MAPK1TLR9
SCHEMBL19405039 0.81 TAF1 (0.61) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404459 0.78 BRD1 (0.73) BRD1BRPF1TAF1MEN1USP2
SCHEMBL19404629 0.78 TAF1 (0.75) BRD1BRPF1TAF1MEN1USP2
SCHEMBL19404605 0.78 TAF1 (0.49) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404455 0.77 BRD1 (0.74) BRD1BRPF1TAF1MEN1USP2
SCHEMBL19404628 0.76 TAF1 (0.59) BRD1BRPF1TAF1BRD4TAF1L

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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