SCHEMBL3661514

SCHEMBL3661514

CCCCC#CCCOc1cccc(N(C)C(=O)c2ccc3ncccc3c2)c1F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.39
HTT P42858 1/20 0.39
PLK1 P53350 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
DOT1L Q8TEK3 1/20 0.36
NOTUM Q6P988 1/20 0.35
PPARG P37231 3/20 0.35
PPARA Q07869 2/20 0.35
RORC P51449 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ALOX5 P09917 1/20 0.34

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
SCHEMBL3658397 0.95 ALOX15 (0.40) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3658756 0.94 ALOX15 (0.40) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3657849 0.93 ALOX15 (0.39) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3656748 0.93 ALOX15 (0.40) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3662943 0.92 ALOX15 (0.40) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3655971 0.91 ALOX15 (0.39) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3270396 0.91 ALOX15 (0.43) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3657878 0.91 ALOX15 (0.39) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3662142 0.90 ALOX15 (0.41) ALOX15HTTPLK1ALDH1A1LMNA
SCHEMBL3656299 0.90 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-2215062-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME Sumitomo Chemical Company, Limited (JP) 2010-08-11 EP disclosed
WO-2009069792-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-04 WO disclosed