SCHEMBL10692857

SCHEMBL10692857

Oc1ccc(Sc2ccc(C(F)(F)F)cn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
ALDH1A1 P00352 3/20 0.48
RECQL P46063 1/20 0.48
HAO1 Q9UJM8 1/20 0.47
KIF11 P52732 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
GFER P55789 1/20 0.43
CDK5 Q00535 1/20 0.43
CDK5R1 Q15078 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B3 P37058 1/20 0.43
NR1H2 P55055 1/20 0.42
KDR P35968 2/20 0.42
BRAF P15056 1/20 0.42
MGLL Q99685 1/20 0.41
DDB1 Q16531 1/20 0.41

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
SCHEMBL4617225 0.80 RAB9A (0.46) RAB9AALDH1A1RECQLHAO1KMT2A
SCHEMBL6251649 0.78 KIF11 (0.64) HAO1KIF11NR1H2MGLL
SCHEMBL11401110 0.74 L3MBTL1 (0.43) RAB9AALDH1A1RECQLKDRBRAF
SCHEMBL25325181 0.74 RAB9A (0.51) RAB9AALDH1A1RECQLHAO1KMT2A
SCHEMBL10946348 0.73 PPARA (0.49) RAB9AALDH1A1KMT2AMEN1GAA
SCHEMBL10696078 0.72 ALDH1A1 (0.49) RAB9AALDH1A1KMT2AMEN1GAA
SCHEMBL6249003 0.71 KDM4E (0.49) RAB9AALDH1A1RECQLKMT2ANPC1
SCHEMBL28737917 0.71 RAB9A (0.49) RAB9AALDH1A1RECQLHAO1KMT2A
SCHEMBL3323097 0.71 RAB9A (0.49) RAB9AALDH1A1RECQLHAO1KMT2A
SCHEMBL1765232 0.70 KIF11 (0.59) RAB9AALDH1A1KIF11KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0017767-B1 TRIFLUOROMETHYL PYRIDINYL(OXY/THIO)PHENOLS THE DOW CHEMICAL COMPANY (US) 1983-03-02 EP claimed
EP-0057473-A2 A process for preparing trifluoromethylpyridyl (oxy/thio) phenoxypropionic compounds being especially active as herbicides THE DOW CHEMICAL COMPANY (US) 1982-08-11 EP claimed
EP-0017767-A1 Trifluoromethyl pyridinyl(oxy/thio)phenols THE DOW CHEMICAL COMPANY (US) 1980-10-29 EP claimed
US-4753673-A GRASSY WEEDS THE DOW CHEMICAL COMPANY (US) 1988-06-28 US disclosed
US-4628099-A INTERMEDIATES FOR HERBICIDES THE DOW CHEMICAL COMPANY (US) 1986-12-09 US disclosed
US-4551170-A Herbicidal trifluoromethyl pyridinyloxyphenoxy and pyridinylthiophenoxy propanols and derivatives thereof THE DOW CHEMICAL COMPANY (US) 1985-11-05 US disclosed
US-4523017-A REACTING CHLORIDE SUBSTITUTED PYRIDINE COMPOUND WITH SUBSTITUTED PHENOL COMPOUND THE DOW CHEMICAL COMPANY (US) 1985-06-11 US disclosed
US-4491468-A Herbicidal trifluoromethyl pyridinyloxyphenoxy and pyridinylthiophenoxy propanenitriles and derivatives thereof THE DOW CHEMICAL COMPANY (US) 1985-01-01 US disclosed
US-4479001-A Trifluoromethyl pyridinylthiophenoxy propanoic acids and propanols and derivatives thereof THE DOW CHEMICAL COMPANY (US) 1984-10-23 US disclosed
EP-0017767-B1 TRIFLUOROMETHYL PYRIDINYL(OXY/THIO)PHENOLS THE DOW CHEMICAL COMPANY (US) 1983-03-02 EP disclosed
EP-0057473-A2 A process for preparing trifluoromethylpyridyl (oxy/thio) phenoxypropionic compounds being especially active as herbicides THE DOW CHEMICAL COMPANY (US) 1982-08-11 EP disclosed
EP-0000483-B1 TRIFLUOROMETHYL PYRIDINYL(OXY/THIO)PHENOXY PROPANOIC ACIDS AND PROPANOLS AND DERIVATIVES THEREOF THE DOW CHEMICAL COMPANY (US) 1981-10-14 EP disclosed
EP-0000483-A1 Trifluoromethyl pyridinyl(oxy/thio)phenoxy propanoic acids and propanols and derivatives thereof THE DOW CHEMICAL COMPANY (US) 1979-02-07 EP disclosed