SCHEMBL8347342

SCHEMBL8347342

ON=CCc1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
MIF P14174 2/20 0.49
IDO1 P14902 2/20 0.49
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
GRIN2B Q13224 2/20 0.47
GRIN1 Q05586 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.43
EPHX1 P07099 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43

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
SCHEMBL8660663 0.82 IDO1 (0.42) IDO1EPHX1
SCHEMBL9802295 0.81 IDO1 (0.54) ACP3TAAR1MIFIDO1HTR2A
SCHEMBL27628915 0.81 IDO1 (0.54) ACP3TAAR1MIFIDO1HTR2A
SCHEMBL7569529 0.79 IDO1 (0.53) ACP3TAAR1MIFIDO1HTR2A
SCHEMBL24208415 0.78 IDO1 (0.50) TAAR1MIFIDO1GRIN2BGRIN1
SCHEMBL39835 0.78 TAAR1 (0.56) ACP3TAAR1MIFIDO1HTR2A
SCHEMBL5703037 0.78 IDO1 (0.59) ACP3TAAR1MIFIDO1HTR2A
SCHEMBL28743534 0.77 IDO1 (0.54) ACP3TAAR1MIFIDO1HTR2A
SCHEMBL10263844 0.77 IDO1 (0.59) ACP3TAAR1MIFIDO1HTR2A
SCHEMBL1048397 0.77 IDO1 (0.54) ACP3TAAR1MIFIDO1HTR2A

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
CN-111295371-A Improved method for preparing trifloxystrobin 海蔻有限公司 2020-06-16 CN disclosed
WO-2013144924-A1 AN IMPROVED PROCESS FOR THE SYNTHESIS OF STROBILURIN FUNGICIDES VIZ TRIFLOXYSTROBIN AND KRESOXIM-METHYL RALLIS INDIA LTD. (IN) 2013-10-03 WO disclosed
WO-1999011129-A1 ENANTIOMERICALLY ENRICHED COMPOSITIONS AND THEIR PESTICIDAL USE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-03-11 WO disclosed
EP-0874831-A1 PROCESSES AND COMPOUNDS FOR PREPARING CYCLIC UREA FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-11-04 EP disclosed
WO-1997019935-A1 PROCESSES AND COMPOUNDS FOR PREPARING CYCLIC UREA FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-06-05 WO disclosed