SCHEMBL1665445

SCHEMBL1665445

FC(F)(F)c1nc2cccnc2s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.53
POLB P06746 2/20 0.46
RAB9A P51151 10/20 0.42
NPC1 O15118 9/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 6/20 0.37
GLA P06280 4/20 0.37
GAA P10253 2/20 0.37
RUNX1 Q01196 2/20 0.37
CBFB Q13951 2/20 0.37
ATM Q13315 3/20 0.36
TOP1 P11387 2/20 0.36
CYP2A6 P11509 1/20 0.35
HPGD P15428 3/20 0.35
MEN1 O00255 2/20 0.35
TSHR P16473 2/20 0.35
KMT2A Q03164 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CASP7 P55210 1/20 0.35

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
SCHEMBL2705690 0.81 PDK1 (0.58) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL23862103 0.76 POLB (0.53) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL22488059 0.76 POLB (0.53) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL28604628 0.75 PDK1 (0.58) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL20312936 0.74 POLB (0.50) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL30190003 0.72 PDK1 (0.60) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL140126 0.72 PDK1 (0.60) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL20312949 0.72 NPC1 (0.53) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL13310867 0.71 PDK1 (0.58) PDK1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL137507 0.71 PDK1 (0.58) PDK1POLBRAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739624-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2014-06-11 EP disclosed
WO-2013018928-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-07 WO disclosed
WO-2011043404-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-14 WO disclosed
US-5683996-A ISOCEPHALOSPORINS; GRAMPOSITIVE BACTERIA ESPECIALLY PENICILLIN-RESISTANT STAPHYLOCOCCUS; GRAMNEGATIVE BACTERIA, PARTICULARLY COLIFORM ROUSSEL UCLAF (FR) 1997-11-04 US disclosed
US-5385897-A 3-(3-quaternary ammonium prop-1-enyl), 7-((2-(aminothiazol-4-yl), 2-(alkoxyimino)acetamido)-3-isocephems; penicillin-resistant staphylococcus ROUSSEL-UCLAF (FR) 1995-01-31 US disclosed