SCHEMBL6547953

SCHEMBL6547953

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

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.58
PPARA Q07869 1/20 0.58
KDM4E B2RXH2 2/20 0.47
FAAH O00519 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SLC22A12 Q96S37 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 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
SCHEMBL8935982 0.87 PPARG (0.71) PPARGPPARAKDM4EFAAHNPSR1
SCHEMBL8935975 0.87 PPARG (0.71) PPARGPPARAKDM4EFAAHNPSR1
SCHEMBL6549025 0.81 PPARG (0.53) PPARGPPARAKDM4ENPSR1SLC22A12
SCHEMBL24854746 0.79 PPARG (0.52) PPARGPPARAKDM4EFAAHNPSR1
SCHEMBL10637985 0.79 OGG1 (0.50) KDM4EL3MBTL1ALDH1A1
SCHEMBL2884339 0.78 ALDH1A1 (0.52) PPARGPPARANPSR1L3MBTL1ALDH1A1
SCHEMBL11800168 0.78 PPARG (0.55) PPARGPPARAKDM4ENPSR1SLC22A12
SCHEMBL23767379 0.77 PPARG (0.61) PPARGPPARAFAAHALDH1A1
SCHEMBL10635054 0.77 PPARG (0.61) PPARGPPARAFAAHALDH1A1
SCHEMBL7772345 0.77 PPARG (0.50) PPARGPPARAKDM4EFAAHNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1180515-B9 BENZOXAZOLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND HERBICIDES UBE INDUSTRIES (JP) 2004-12-01 EP disclosed
EP-1180515-B1 BENZOXAZOLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND HERBICIDES UBE INDUSTRIES (JP) 2004-04-14 EP disclosed
US-6706664-B1 Benzoxazole compounds, process for the preparation thereof and herbicides UBE INDUSTRIES, LTD. (JP) 2004-03-16 US disclosed
EP-1180515-A1 BENZOXAZOLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND HERBICIDES Ube Industries, Ltd. (JP) 2002-02-20 EP disclosed
US-4753674-A PLANT GROWTH REGULATORS UBE INDUSTRIES, LTD. (JP) 1988-06-28 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