SCHEMBL9420232

SCHEMBL9420232

CC(Oc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.67
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
TTR P02766 1/20 0.53
PPOX P50336 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
PTGDR2 Q9Y5Y4 4/20 0.51
HTR2A P28223 1/20 0.46
SLC6A4 P31645 1/20 0.46
KCNH2 Q12809 1/20 0.46
ABCB11 O95342 1/20 0.45
PPARG P37231 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.44

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
Hydrochloric Acid SCHEMBL10942896 0.99 FFAR1 (0.65) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL8918684 0.91 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL204622 0.91 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10615272 0.90 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10856612 0.90 FFAR1 (0.60) FFAR1MEN1KMT2ATTRPPOX
Hydrochloric Acid SCHEMBL10642889 0.90 FFAR1 (0.57) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL11186418 0.89 FFAR1 (0.60) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL11258766 0.89 FFAR1 (0.59) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10966962 0.88 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL732095 0.88 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0330904-B1 Herbicidal agent in the form of aqueous microemulsions HOECHST AG (DE) 1994-04-20 EP claimed
EP-0201775-A2 Derivative of propionic acid and selective herbicide containing the same AGRO-KANESHO CO., LTD. (JP) 1986-11-20 EP claimed
JP-57120551-A None JP disclosed
JP-57120551-A None JP disclosed
EP-0543878-A1 PLANT PROTECTING AGENTS CONTAINING ISOXAZOLINE OR ISOTHIAZOLINE AND NEW ISOXAZOLINES AND ISOTHIAZOLINES. HOECHST AG (DE) 1993-06-02 EP disclosed
US-4531969-A Combatting growth of weeds HOECHST AKTIENGESELLSCHAFT (DE) 1985-07-30 US disclosed
US-4522647-A Substituted phenoxyalkanediones and their herbicidal method of use ZOECON CORPORATION (US) 1985-06-11 US disclosed
US-4497965-A PRE-AND POSTEMERGENT HERBICIDES ZOECON CORPORATION (US) 1985-02-05 US disclosed
EP-0109483-A1 Substituted phenoxyalkane diones, intermediates for these compounds and the use of phenoxyalkane diones in the control of weeds ZOECON CORPORATION (US) 1984-05-30 EP disclosed
US-4448966-A HERBICIDES ZOECON CORPORATION (US) 1984-05-15 US disclosed
JP-S57120551-A 2-(4-(2-CHLORO-4-TRIFLUOROMETHYLPHENOXY)-PHENOXY)- PROPIONIC ACID DERIVATIVE MITSUI TOATSU CHEM INC 1982-07-27 JP disclosed
US-4335249-A PREEMERGENCE AND POSTEMERGENCE ROHM AND HAAS COMPANY (US) 1982-06-15 US disclosed
US-4332961-A BENZYL ESTER OF 4-TRIFLUOROMETHYLPHENOXYPHENOXYALKANECARBOXYLIC ACID ISHIHARA SANGYO KAISHA, LTD. (JP) 1982-06-01 US disclosed
US-4332960-A (4-TRIFLUOROMETHYLPHENOXY) PHENOXY PROPIONATE HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-01 US disclosed
US-4314069-A ESTERS OF A-(4-(4-TRIFLUOROMETHYL)PHENOXY)0PHENOXY)ALKANECARBOXYLIC ACIDS ISHIHARA SANGYO KAISHA, LTD. (JP) 1982-02-02 US disclosed
US-4309562-A SELECTIVE KILLING OF GRASSY WEEDS IN BROAD-LEAFED CROPS ISHIHARA SANGYO KAISHA, LTD. (JP) 1982-01-05 US disclosed
US-4309210-A HERBICIDE AND SAFENING AGENT CIBA-GEIGY CORPORATION (US) 1982-01-05 US disclosed
US-4270948-A (TRIFLUOROMETHYLPHENOXY)PHENOXYALKANE THIOCARBOXYLATE ISHIHARA SANGYO KAISHA LTD. (JP) 1981-06-02 US disclosed
US-4259532-A TRIFLUOROMETHOXYHALOPHENOL E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-03-31 US disclosed
US-4070178-A Herbicidal diphenyl ethers ROHM AND HAAS COMPANY (US) 1978-01-24 US disclosed