SCHEMBL10396535

SCHEMBL10396535

CC(=O)N(Cl)c1cc(Br)c2cccc3c2c1C(=O)NC3=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.37
▸ POLB P06746 3/20 0.36
▸ PARP1 P09874 3/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RGS12 O14924 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ CASP1 P29466 1/20 0.36

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
SCHEMBL10396748 0.87 KDM4E (0.39) KDM4EHSD17B10GAAALDH1A1HPGD
SCHEMBL11713701 0.84 CDK2 (0.39) KDM4EHSD17B10GAAALDH1A1HPGD
SCHEMBL10396745 0.78 PARP1 (0.49) KDM4EHSD17B10GAAALDH1A1HPGD
SCHEMBL10396143 0.77 PKM (0.36) KDM4EHSD17B10GAAALDH1A1HPGD
SCHEMBL10396744 0.72 ALDH1A1 (0.35) KDM4EHSD17B10GAAALDH1A1HPGD
SCHEMBL29576080 0.68 PTPRB (0.42) KDM4EHSD17B10ALDH1A1HPGDNPSR1
SCHEMBL30517110 0.67 POLB (0.62) KDM4EALDH1A1NPSR1POLBPARP1
SCHEMBL1888975 0.67 POLB (0.62) KDM4EALDH1A1NPSR1POLBPARP1
SCHEMBL28114523 0.66 MEN1 (0.50) KDM4EHSD17B10GAAALDH1A1HPGD
SCHEMBL9728369 0.66 POLB (0.48) KDM4EALDH1A1NPSR1POLBPARP1

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
US-4919848-A Process for the quenching of fluorescence, and new cationic naphthalene-peri-dicarboxylic acid imide derivatives BAYER AKTIENGESELLSCHAFT (DE) 1990-04-24 — — US disclosed
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