SCHEMBL919518

SCHEMBL919518

Cc1cc(C)c(Oc2ccc(CN)cc2)c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 3/20 0.57
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AR P10275 1/20 0.41
MAOB P27338 7/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
LPAR1 Q92633 1/20 0.37
LPAR5 Q9H1C0 1/20 0.37
HRH3 Q9Y5N1 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
SCHEMBL921691 0.85 ST14 (0.55) ST14MAOBKEAP1NFE2L2LPAR1
SCHEMBL920355 0.81 ST14 (0.73) ST14ALDH1A1SMN1; SMN2MAOBKEAP1
SCHEMBL11588965 0.80 TEAD4 (0.48) ALDH1A1SMN1; SMN2AR
SCHEMBL921987 0.79 ST14 (0.53) ST14ALDH1A1KEAP1NFE2L2
SCHEMBL9321941 0.79 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2ARMAOB
SCHEMBL920927 0.78 ST14 (0.68) ST14ALDH1A1SMN1; SMN2MAOBKEAP1
SCHEMBL921291 0.78 ST14 (0.52) ST14MAOBKEAP1NFE2L2LPAR1
SCHEMBL29606473 0.76 ST14 (0.65) ST14ALDH1A1SMN1; SMN2MAOBKEAP1
Hydrochloric Acid SCHEMBL6160193 0.76 ST14 (0.65) ST14ALDH1A1MAOBKEAP1NFE2L2
SCHEMBL921340 0.76 ST14 (0.64) ST14ALDH1A1SMN1; SMN2MAOBKEAP1

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 5 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
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
WO-2009107764-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS 住友化学株式会社 (JP) 2009-09-03 WO 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 ST14 708/4885ALDH1A1 2743/4885SMN1; SMN2 4796/4885

“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.