SCHEMBL7108244

SCHEMBL7108244

COc1cc(Oc2cccc(OC(F)(F)F)c2)nc(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
PPARG P37231 1/20 0.42
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MCL1 Q07820 1/20 0.41
LOXL2 Q9Y4K0 2/20 0.40
SCN9A Q15858 3/20 0.39
CHRM5 P08912 1/20 0.39
LDHA P00338 1/20 0.39
F10 P00742 2/20 0.39
MMP13 P45452 1/20 0.39
BRAF P15056 1/20 0.39
F2 P00734 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
DHODH Q02127 1/20 0.38

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
SCHEMBL8074651 0.90 MAPT (0.57) MAPTNPC1RAB9ALOXL2SCN9A
SCHEMBL8074659 0.86 MAPT (0.47) MAPTKDM4ENPC1RAB9ALOXL2
SCHEMBL8773239 0.86 LOX (0.47) MAPTKDM4ELOXL2CHRM5F10
SCHEMBL7048317 0.86 NPC1 (0.51) MAPTKDM4ENPC1RAB9ALOXL2
SCHEMBL7049881 0.85 MAPT (0.63) MAPTPPARGKDM4EPOLBRAB9A
SCHEMBL8058715 0.81 MCL1 (0.43) MAPTKDM4EPOLBNPC1RAB9A
SCHEMBL8773188 0.77 MAOB (0.51) PPARGLOXL2CHRM5ALDH1A1
SCHEMBL7108315 0.77 CTSS (0.41) MAPTPPARGKDM4ENPC1RAB9A
SCHEMBL26036507 0.76 RAF1 (0.50) PPARGSCN9ALDHABRAF
SCHEMBL8509396 0.75 F10 (0.47) MAPTLOXL2CHRM5F10F2

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-0949248-B1 6-(NONSUBSTITUTED OR SUBSTITUTED) PHENOXYPICOLINIC ACIDS, PROCESS OF PREPARING THE SAME, AND AGRICULTURAL/HORTICULTURAL GERMICIDES CONTAINING THE SAME KUREHA CHEMICAL IND CO LTD (JP) 2003-10-08 EP disclosed
US-6200933-B1 LOW TOXICITY TO HUMANS AND CATTLE KUREHA KAGAKU KABUSHIKI KAISHA (JP) 2001-03-13 US disclosed
US-6159901-A 6-phenoxy picolinic acid alkylidene hydrazide derivative, process for producing the same and herbicide using the same KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2000-12-12 US disclosed
EP-1020444-A1 6-PHENOXYPICOLINIC ACID, ALKYLIDENEHYDRAZIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND HERBICIDE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2000-07-19 EP disclosed
EP-0949248-A1 6-(NONSUBSTITUTED OR SUBSTITUTED) PHENOXYPICOLINIC ACIDS, PROCESS OF PREPARING THE SAME, AND AGRICULTURAL/HORTICULTURAL GERMICIDES CONTAINING THE SAME KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1999-10-13 EP disclosed