SCHEMBL921880

SCHEMBL921880

Cc1ccc(C(=O)NCc2ccc(Oc3cccc(CC(C)(C)C)c3)cc2)c(N)n1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.46
PPARD Q03181 14/20 0.46
PPARA Q07869 14/20 0.46
MMP13 P45452 1/20 0.44
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
MAPK14 Q16539 1/20 0.43
CHRM4 P08173 2/20 0.42
KLKB1 P03952 1/20 0.42
KLK1 P06870 1/20 0.42
FLT1 P17948 1/20 0.41
LRRK2 Q5S007 1/20 0.41

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
SCHEMBL920171 0.91 ADORA2A (0.46) PPARDPPARAMMP13KDM4EALDH1A1
SCHEMBL921421 0.90 PPARG (0.44) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL920232 0.89 MMP13 (0.44) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL919767 0.89 MMP13 (0.46) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL921582 0.88 MMP13 (0.43) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL921382 0.87 PPARG (0.43) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL921580 0.87 MMP13 (0.58) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL920420 0.87 MAPK14 (0.49) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL920750 0.87 KDM4E (0.54) PPARGPPARDPPARAMMP13KDM4E
SCHEMBL921219 0.87 KLKB1 (0.42) PPARGPPARDPPARAMMP13KDM4E

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 PPARG 391/4885PPARD 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.