SCHEMBL7658260

SCHEMBL7658260

CCOC(=O)c1cc2c(Cl)ccc(N)c2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.52
CCNB1 P14635 1/20 0.52
ALOX15 P16050 1/20 0.48
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 4/20 0.44
RAB9A P51151 4/20 0.44
HPGD P15428 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HSD17B10 Q99714 2/20 0.44
MMP2 P08253 1/20 0.43
MMP13 P45452 1/20 0.43
NPC1 O15118 3/20 0.43
LMNA P02545 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
GLA P06280 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
TP53 P04637 1/20 0.41

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
SCHEMBL8325034 0.89 CDK1 (0.63) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL1654809 0.86 ALDH1A1 (0.46) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL8318032 0.86 CDK1 (0.54) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL5357191 0.84 CDK1 (0.52) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL4174868 0.84 CDK1 (0.52) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL7665395 0.80 FBP1 (0.53) CDK1CCNB1ALOX15ALDH1A1LMNA
SCHEMBL4160760 0.80 CDK1 (0.51) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL1654469 0.79 CDK1 (0.40) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL28844731 0.78 ALOX15 (0.45) CDK1CCNB1ALOX15ALDH1A1KDM4E
SCHEMBL22042078 0.78 CDK1 (0.58) CDK1CCNB1ALOX15ALDH1A1KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6352958-B1 PRE- AND POST-EMERGENCE HERBICIDES FMC CORPORATION 2002-03-05 US disclosed
US-6077812-A 4-OR 7-(2,6-DI(OXO),3-SUBSTITUTED, 4-TRIFLUOROMETHYL-1,2,3, 6-TETRAHYDROPYRIMIDIN-1-YL)BENZIMIDAZOLES; CONTROLLING WEEDS FMC CORPORATION (US) 2000-06-20 US disclosed
EP-0968207-A1 CYCLOIMIDO-SUBSTITUTED BENZOFUSED HETEROCYCLIC HERBICIDES FMC CORPORATION (US) 2000-01-05 EP disclosed
WO-1998038188-A1 CYCLOIMIDO-SUBSTITUTED BENZOFUSED HETEROCYCLIC HERBICIDES FMC CORPORATION (US) 1998-09-03 WO disclosed