SCHEMBL921940

SCHEMBL921940

COCc1ccc(C(=O)NCc2ccc(Oc3cccc(OC(F)(F)F)c3)cc2)c(N)n1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.49
PPARD Q03181 6/20 0.48
PPARA Q07869 6/20 0.48
PPARG P37231 5/20 0.48
HTR2C P28335 1/20 0.45
MMP13 P45452 1/20 0.42
KLKB1 P03952 1/20 0.41
RECQL P46063 1/20 0.41
EPHX2 P34913 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
PDE2A O00408 1/20 0.40
NAMPT P43490 1/20 0.40
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL919789 0.94 PPARG (0.53) MAPK14PPARDPPARAPPARGMMP13
SCHEMBL921027 0.93 MAPK14 (0.54) MAPK14PPARDPPARAPPARGHTR2C
SCHEMBL921528 0.93 EPHX2 (0.47) MAPK14PPARDPPARAPPARGHTR2C
SCHEMBL920786 0.90 LIPG (0.41) MAPK14PPARDPPARAPPARGHTR2C
SCHEMBL922036 0.90 KDM4E (0.48) PPARDPPARAPPARGMMP13ROCK2
SCHEMBL920726 0.89 RECQL (0.51) MAPK14PPARDPPARAPPARGRECQL
SCHEMBL921541 0.88 HPGD (0.44) MAPK14PPARDPPARAPPARGMMP13
SCHEMBL920083 0.88 HTR2C (0.45) PPARDPPARAPPARGHTR2CKLKB1
SCHEMBL922456 0.88 PPARD (0.42) PPARDPPARAPPARGHTR2CEPHX2
SCHEMBL921950 0.88 PPARD (0.42) MAPK14PPARDPPARAPPARGHTR2C

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 3 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
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 MAPK14 905/4885PPARD 360/4885PPARA 494/4885

“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.