SCHEMBL10696078

SCHEMBL10696078

Oc1ccc(Sc2ncc(C(F)(F)F)cc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
PKM P14618 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
GAA P10253 3/20 0.46
RAB9A P51151 1/20 0.45
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PLAU P00749 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL7671680 0.85 KMT2A (0.51) ALDH1A1L3MBTL1MEN1KMT2ACYP1A2
SCHEMBL10585719 0.76 CYP1A2 (0.46) ALDH1A1L3MBTL1PKMMEN1KMT2A
SCHEMBL10690529 0.76 KMT2A (0.53) ALDH1A1L3MBTL1PKMMEN1KMT2A
SCHEMBL7678588 0.75 ALDH1A1 (0.44) ALDH1A1L3MBTL1MEN1KMT2ACYP1A2
SCHEMBL2712022 0.74 KMT2A (0.46) ALDH1A1L3MBTL1MEN1KMT2ACYP1A2
SCHEMBL6977861 0.74 ALDH1A1 (0.60) ALDH1A1PKMMEN1KMT2ARAB9A
SCHEMBL11265653 0.74 PDE7A (0.45) ALDH1A1PKMMEN1KMT2AMAPT
SCHEMBL2712102 0.73 KMT2A (0.55) ALDH1A1L3MBTL1MEN1KMT2ACYP1A2
SCHEMBL10694731 0.73 MEN1 (0.47) ALDH1A1L3MBTL1PKMMEN1KMT2A
SCHEMBL6970766 0.73 ALDH1A1 (0.49) ALDH1A1L3MBTL1PKMMEN1KMT2A

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 14 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-0017767-A1 Trifluoromethyl pyridinyl(oxy/thio)phenols THE DOW CHEMICAL COMPANY (US) 1980-10-29 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