SCHEMBL19405059

SCHEMBL19405059

CCn1c(=O)n(CC)c2cc(N3C(=O)c4cccc5cccc(c45)C3=O)c(C)cc21

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BRD1 O95696 17/20 0.70
▸ BRPF1 P55201 17/20 0.70
▸ TAF1 P21675 15/20 0.70
▸ BRD4 O60885 3/20 0.70
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ CYP1B1 Q16678 1/20 0.49
▸ TAF1L Q8IZX4 1/20 0.47
▸ CREBBP Q92793 1/20 0.47
▸ CECR2 Q9BXF3 1/20 0.47
▸ BRPF3 Q9ULD4 1/20 0.47

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
SCHEMBL19405060 0.90 BRD1 (0.74) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19405003 0.83 BRD1 (0.74) BRD1BRPF1TAF1BRD4CYP1B1
SCHEMBL19404501 0.83 BRD1 (1.00) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404837 0.79 BRD1 (0.54) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404615 0.79 TAF1 (0.79) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404530 0.79 BRD1 (0.52) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404625 0.78 BRD1 (0.77) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404511 0.73 BRD1 (1.00) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404430 0.73 BRD1 (1.00) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404815 0.73 BRD1 (1.00) 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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