SCHEMBL3270396

SCHEMBL3270396

CCCCCOc1cccc(N(C)C(=O)c2ccc3ncccc3c2)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
PLK1 P53350 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DOT1L Q8TEK3 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
NOTUM Q6P988 1/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TRPV1 Q8NER1 2/20 0.38
RORC P51449 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL3268481 0.94 ALOX15 (0.45) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3661514 0.91 ALOX15 (0.39) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3660094 0.91 ALOX15 (0.39) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3275312 0.90 ALOX15 (0.46) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3658756 0.90 ALOX15 (0.40) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3654471 0.90 ALOX15 (0.40) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3661690 0.90 ALOX15 (0.41) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3658453 0.89 ALOX15 (0.39) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3655971 0.89 ALOX15 (0.39) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3661365 0.89 ALOX15 (0.40) ALOX15HTTPLK1ALDH1A1LMNA

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
EP-2200988-A1 N-BENZYL QUINOLINE-6-CARBOXAMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME Sumitomo Chemical Company, Limited (JP) 2010-06-30 EP disclosed
WO-2009051086-A1 N-BENZYL QUINOLINE-6-CARBOXAMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-23 WO disclosed