SCHEMBL19405060

SCHEMBL19405060

CCn1c(=O)n(CC)c2cc(N3C(=O)c4cccc5cc(O)cc(c45)C3=O)c(C)cc21

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BRD1 O95696 16/20 0.74
▸ BRPF1 P55201 16/20 0.74
▸ TAF1 P21675 14/20 0.74
▸ BRD4 O60885 3/20 0.58
▸ POLB P06746 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ TAF1L Q8IZX4 1/20 0.44
▸ CREBBP Q92793 1/20 0.44
▸ CECR2 Q9BXF3 1/20 0.44
▸ BRPF3 Q9ULD4 1/20 0.44
▸ CYP1B1 Q16678 1/20 0.41

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
SCHEMBL19405059 0.90 BRD1 (0.70) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404511 0.85 BRD1 (1.00) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19405003 0.77 BRD1 (0.74) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404510 0.77 BRD1 (0.72) BRD1BRPF1TAF1BRD4POLB
SCHEMBL13893856 0.74 CYP1B1 (0.71) BRD1BRPF1TAF1POLBMEN1
SCHEMBL19404530 0.74 BRD1 (0.52) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404615 0.74 TAF1 (0.79) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404501 0.74 BRD1 (1.00) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404837 0.73 BRD1 (0.54) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404815 0.72 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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