SCHEMBL3660490

SCHEMBL3660490

C#CCCCCCCOc1cccc(N(C)C(=O)c2ccc3ncccc3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
DOT1L Q8TEK3 1/20 0.42
PLK1 P53350 1/20 0.41
HSD17B2 P37059 2/20 0.40
HSD17B1 P14061 1/20 0.40
MTNR1A P48039 6/20 0.40
MTNR1B P49286 6/20 0.40
PDE10A Q9Y233 4/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL3661703 1.00 ALOX15 (0.43) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3662845 0.99 ALOX15 (0.44) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3658385 0.96 ALOX15 (0.45) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3663749 0.94 ALOX15 (0.45) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3659125 0.91 ALOX15 (0.42) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3654515 0.90 ALOX15 (0.42) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3661185 0.89 ALOX15 (0.42) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3661387 0.88 ALOX15 (0.46) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3658207 0.86 ALOX15 (0.43) ALOX15HTTDOT1LPLK1HSD17B2
SCHEMBL3660087 0.86 ALOX15 (0.42) ALOX15HTTDOT1LPLK1HSD17B2

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