SCHEMBL12779092

SCHEMBL12779092

C/C(=N\OCc1ccc(C(F)(F)F)cc1)c1cc(Cl)ccc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
S1PR1 P21453 6/20 0.43
CCR5 P51681 2/20 0.39
SLC6A4 P31645 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TMPRSS4 Q9NRS4 1/20 0.38
CA12 O43570 1/20 0.37
MAOB P27338 2/20 0.37
IDO1 P14902 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
S1PR3 Q99500 1/20 0.36

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
SCHEMBL12779102 0.94 MAPT (0.49) MAPTL3MBTL1MEN1KMT2APPARG
SCHEMBL12779177 0.90 P2RX1 (0.41) MAPTL3MBTL1MEN1KMT2AS1PR1
SCHEMBL12779124 0.89 L3MBTL1 (0.44) MAPTL3MBTL1MEN1KMT2APPARG
SCHEMBL12779122 0.89 NPC1 (0.46) MAPTL3MBTL1MEN1KMT2APPARG
SCHEMBL12779096 0.87 NPC1 (0.46) MAPTL3MBTL1PPARGPPARASLC6A4
SCHEMBL12779582 0.87 MAPT (0.40) MAPTL3MBTL1MEN1KMT2ASLC6A4
SCHEMBL14099993 0.87 PPARG (0.42) MAPTL3MBTL1MEN1KMT2APPARG
SCHEMBL12779173 0.87 MAPT (0.41) MAPTL3MBTL1MEN1KMT2AS1PR1
SCHEMBL12779105 0.86 NPC1 (0.49) MAPTL3MBTL1MEN1KMT2APPARG
SCHEMBL12779312 0.86 L3MBTL1 (0.52) MAPTL3MBTL1MEN1KMT2AS1PR1

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
US-7906538-B2 Parasiticides; nematocides; crop protection SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2011-03-15 US disclosed
US-7312248-B2 Control of parasites in animals by the use of novel trifluoromethanesulfonanilide oxime ether derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2007-12-25 US disclosed