SCHEMBL19404591

SCHEMBL19404591

Cc1cc2[nH]c(=O)n(C)c2cc1N1C(=O)c2cccc3c(Cl)ccc(c23)C1=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD1 O95696 15/20 0.71
▸ BRPF1 P55201 15/20 0.71
▸ TAF1 P21675 15/20 0.71
▸ KDM4E B2RXH2 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ HPGD P15428 1/20 0.56
▸ BRD4 O60885 3/20 0.51
▸ KMT2A Q03164 1/20 0.49
▸ TAF1L Q8IZX4 1/20 0.48
▸ CREBBP Q92793 1/20 0.48
▸ CECR2 Q9BXF3 1/20 0.48
▸ BRPF3 Q9ULD4 1/20 0.48
▸ LMNA P02545 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ ERCC1 P07992 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ FEN1 P39748 1/20 0.44

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
SCHEMBL19405013 0.91 TAF1 (0.61) BRD1BRPF1TAF1KDM4EALDH1A1
SCHEMBL19404590 0.88 TAF1 (0.57) BRD1BRPF1TAF1KDM4EALDH1A1
SCHEMBL19404528 0.87 BRD1 (0.71) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404459 0.84 BRD1 (0.73) BRD1BRPF1TAF1KDM4EALDH1A1
SCHEMBL19404593 0.83 BRD1 (1.00) BRD1BRPF1TAF1BRD4TAF1L
SCHEMBL19404455 0.83 BRD1 (0.74) BRD1BRPF1TAF1ALDH1A1HPGD
SCHEMBL19405012 0.83 KDM4E (0.59) BRD1BRPF1TAF1KDM4EALDH1A1
SCHEMBL19404507 0.82 TAF1 (0.58) BRD1BRPF1TAF1KDM4EALDH1A1
SCHEMBL19404629 0.81 TAF1 (0.75) BRD1BRPF1TAF1ALDH1A1BRD4
SCHEMBL19404460 0.81 BRD1 (0.75) BRD1BRPF1TAF1BRD4KMT2A

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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