SCHEMBL19404625

SCHEMBL19404625

CCn1c(=O)n(CC)c2cc(N3C(=O)c4cccc5c(N6CCOCC6)ccc(c45)C3=O)c(C)cc21

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD1 O95696 14/20 0.77
▸ BRPF1 P55201 14/20 0.77
▸ TAF1 P21675 13/20 0.77
▸ BRD4 O60885 2/20 0.64
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ TAF1L Q8IZX4 1/20 0.46
▸ CREBBP Q92793 1/20 0.46
▸ CECR2 Q9BXF3 1/20 0.46
▸ BRPF3 Q9ULD4 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ RAB9A P51151 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
SCHEMBL19404521 0.87 BRD1 (1.00) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404857 0.85 BRD1 (0.77) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19405003 0.81 BRD1 (0.74) BRD1BRPF1TAF1BRD4LMNA
SCHEMBL19405037 0.79 BRD1 (1.00) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL18648444 0.78 MEN1 (0.64) BRD1BRPF1TAF1MEN1KMT2A
SCHEMBL19405059 0.78 BRD1 (0.70) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19405032 0.78 BRD1 (1.00) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404467 0.78 BRD1 (1.00) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404616 0.77 BRD1 (0.66) BRD1BRPF1TAF1BRD4MEN1
SCHEMBL19404532 0.77 BRD1 (0.66) 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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