SCHEMBL921868

SCHEMBL921868

COCc1ccc(C(=O)NCc2ccc(Oc3ccc(F)c(OC(F)(F)F)c3)cc2)c(N)n1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 9/20 0.40
PPARA Q07869 9/20 0.40
PPARG P37231 8/20 0.40
LIPG Q9Y5X9 1/20 0.39
RIPK1 Q13546 1/20 0.39
KLKB1 P03952 1/20 0.39
EPHX2 P34913 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
HTR2C P28335 1/20 0.38
MAPK14 Q16539 1/20 0.38
MAPK1 P28482 1/20 0.37
PDE2A O00408 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER2 P43116 1/20 0.37

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
SCHEMBL922456 0.93 PPARD (0.42) PPARDPPARAPPARGLIPGEPHX2
SCHEMBL921950 0.93 PPARD (0.42) PPARDPPARAPPARGLIPGRIPK1
SCHEMBL921528 0.89 EPHX2 (0.47) PPARDPPARAPPARGLIPGKLKB1
SCHEMBL921805 0.88 PPARD (0.43) PPARDPPARAPPARGKLKB1EPHX2
SCHEMBL921940 0.88 MAPK14 (0.49) PPARDPPARAPPARGKLKB1EPHX2
SCHEMBL919842 0.88 PTPN7 (0.40) PPARDPPARAPPARGLIPGMAPK14
SCHEMBL920870 0.88 CARM1 (0.42) PPARDPPARALIPGKLKB1EPHX2
SCHEMBL922052 0.88 PPARD (0.43) PPARDPPARAPPARGLIPGRIPK1
SCHEMBL921339 0.87 KLKB1 (0.42) PPARDPPARAPPARGLIPGRIPK1
SCHEMBL920418 0.87 HTR2C (0.40) PPARDPPARAPPARGLIPGKLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 PPARD 360/4885PPARA 494/4885PPARG 391/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.