SCHEMBL10396142

SCHEMBL10396142

CC(=O)N(Cl)c1c2c(c3cccc(Cl)c3c1Cl)C(=O)NC2=O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 3/20 0.36
▸ WEE1 P30291 11/20 0.34
▸ CHEK1 O14757 10/20 0.34
▸ EGFR P00533 1/20 0.33
▸ PRKCA P17252 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPKAPK2 P49137 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ PBRM1 Q86U86 1/20 0.32

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
SCHEMBL11420985 0.76 CES1 (0.44) TGM2WEE1CHEK1EGFRPRKCA
SCHEMBL11713698 0.73 KDR (0.39) KDM4EALDH1A1HPGDMAPKAPK2JAK3
SCHEMBL11533447 0.71 WEE1 (0.37) WEE1CHEK1EGFRPRKCAKDM4E
SCHEMBL10396748 0.70 KDM4E (0.39) TGM2WEE1CHEK1PRKCAKDM4E
SCHEMBL11765410 0.70 WEE1 (0.42) WEE1CHEK1EGFRPRKCAJAK3
SCHEMBL11531116 0.68 CHEK1 (0.35) WEE1CHEK1PRKCAKDM4EGAA
SCHEMBL10396744 0.67 ALDH1A1 (0.35) PRKCAKDM4EALDH1A1GAAHPGD
SCHEMBL10396143 0.67 PKM (0.36) WEE1CHEK1PRKCAKDM4EALDH1A1
SCHEMBL11535554 0.66 GSK3B (0.37) WEE1CHEK1KDM4EALDH1A1GAA
SCHEMBL11756770 0.65 PARP1 (0.45) WEE1CHEK1JAK3

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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