SCHEMBL10396745

SCHEMBL10396745

CC(=O)N(Cl)c1ccc2cccc3c2c1C(=O)NC3=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 3/20 0.49
▸ KDM4E B2RXH2 4/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.38
▸ CASP3 P42574 1/20 0.37
▸ PKM P14618 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ RXFP1 Q9HBX9 2/20 0.34
▸ POLB P06746 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ TYMS P04818 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33
▸ RGS12 O14924 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33

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 0.79 KDM4E (0.39) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL10396535 0.78 KDM4E (0.39) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL28839383 0.77 PARP1 (0.40) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL1052126 0.76 PARP1 (0.56) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL11713701 0.76 CDK2 (0.39) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL10396143 0.75 PKM (0.36) KDM4EHSD17B10ALDH1A1HPGDGAA
SCHEMBL3257586 0.72 PARP1 (0.54) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL1756367 0.72 PARP1 (0.63) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL6848270 0.72 PARP1 (0.63) PARP1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL21450709 0.72 PARP1 (0.63) PARP1KDM4EHSD17B10ALDH1A1HPGD

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 2 patents. 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
US-4197111-A 1,8-Naphthalimides and herbicide antidotes STAUFFER CHEMICAL COMPANY (US) 1980-04-08 — — US disclosed
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