SCHEMBL8935975

SCHEMBL8935975

CCC(Oc1cccc(C(F)(F)F)c1)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.71
PPARA Q07869 5/20 0.71
SMN1; SMN2 Q16637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.49
PTGES O14684 1/20 0.48
ALOX5 P09917 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
KDM4E B2RXH2 2/20 0.48
PPARD Q03181 1/20 0.48
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
FAAH O00519 1/20 0.46

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
SCHEMBL8935982 1.00 PPARG (0.71) PPARGPPARASMN1; SMN2NPSR1PTGES
SCHEMBL6547953 0.87 PPARG (0.58) PPARGPPARANPSR1MRGPRX4KDM4E
SCHEMBL10936223 0.86 SMN1; SMN2 (0.54) PPARGPPARASMN1; SMN2PTGDR2PPARD
SCHEMBL16571566 0.83 PPARG (0.67) PPARGPPARASMN1; SMN2PTGDR2
SCHEMBL11019660 0.82 PPARG (0.59) PPARGPPARAPTGESALOX5FAAH
SCHEMBL9797759 0.82 PPARG (0.66) PPARGPPARANPSR1PTGESALOX5
SCHEMBL23767379 0.81 PPARG (0.61) PPARGPPARAALDH1A1FAAH
SCHEMBL10635054 0.81 PPARG (0.61) PPARGPPARAALDH1A1FAAH
Hydrochloric Acid SCHEMBL9811662 0.81 PPARG (0.64) PPARGPPARANPSR1PTGESALOX5
SCHEMBL24854746 0.80 PPARG (0.52) PPARGPPARANPSR1MRGPRX4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3046912-A1 DISUBSTITUTED TRIFLUORMETHYL PYRIMIDINONES AND USE THEREOF AS CCR2 ANTAGONISTS Bayer Pharma Aktiengesellschaft (DE) 2016-07-27 EP disclosed
WO-2015036563-A1 DISUBSTITUTED TRIFLUORMETHYL PYRIMIDINONES AND USE THEREOF AS CCR2 ANTAGONISTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-03-19 WO disclosed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed
EP-0289100-B1 ANILIDE HERBICIDES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-04-01 EP disclosed
US-4994616-A Anilide herbicides UBE INDUSTRIES, LTD. (JP) 1991-02-19 US disclosed
EP-0289100-A2 Anilide herbicides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-11-02 EP disclosed
US-4297516-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1981-10-27 US disclosed
EP-0002590-B1 NOVEL PROSTAGLANDIN COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMERICAN CYANAMID COMPANY (US) 1981-09-30 EP disclosed
US-4254285-A 1-Hydroxymethyl-1-1-oxo prostane derivatives of the E and F series AMERICAN CYANAMID COMPANY (US) 1981-03-03 US disclosed
US-4235797-A CHEMICAL INTERMEDIATES FOR PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1980-11-25 US disclosed
US-4197245-A 1-Hydroxymethyl-1-oxo-prostane derivatives of the A1 series AMERICAN CYANAMID COMPANY (US) 1980-04-08 US disclosed
US-4189597-A PROSTAGLANDINS, BRONCHODILATORS AMERICAN CYANAMID COMPANY (US) 1980-02-19 US disclosed
US-4172839-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1979-10-30 US disclosed
US-4170597-A 1-Hydroxymethyl-1-oxo-prostane derivatives of the E2 series AMERICAN CYANAMID COMPANY (US) 1979-10-09 US disclosed
US-4165331-A PROSTAGLANDINS/AND DERIVATIVES AMERICAN CYANAMID COMPANY (US) 1979-08-21 US disclosed
EP-0002590-A1 Novel prostaglandin compounds, processes for the preparation thereof and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1979-06-27 EP disclosed
US-4154959-A 11-(2-Hydroxyethylthio)prostenoic acid E series derivatives AMERICAN CYANAMID COMPANY (US) 1979-05-15 US disclosed
US-4154954-A BRONCHODILATOR AGENTS; ANTIINFLAMMATORY AGENTS AMERICAN CYANAMID COMPANY (US) 1979-05-15 US disclosed
US-4085272-A BRONCHODILATORS, INFLAMMATORY MEDEATOR RELEASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1978-04-18 US disclosed
US-3971850-A N-substituted-N-(1-substituted-1-methyl-2-propynyl)-α-(substituted phenoxy) alkylamides and their use as miticides STAUFFER CHEMICAL COMPANY (US) 1976-07-27 US disclosed