SCHEMBL921783

SCHEMBL921783

Cc1ccc(Oc2ccc(CNC(=O)c3ccc(C)nc3N)s2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPK14 Q16539 2/20 0.38
MMP2 P08253 1/20 0.38
CYP3A4 P08684 1/20 0.38
STAT3 P40763 1/20 0.38
HTT P42858 1/20 0.38
ADORA2A P29274 2/20 0.37
ADORA1 P30542 2/20 0.37
ALDH1A1 P00352 4/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 3/20 0.36
HSD17B10 Q99714 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.36
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL920425 0.92 KLKB1 (0.40) MAPK14CYP3A4HTTADORA2AADORA1
SCHEMBL921914 0.88 KLKB1 (0.40) SMN1; SMN2ADORA2AALDH1A1HPGDKDM4E
SCHEMBL1680807 0.84 GAA (0.49) MMP13SMN1; SMN2MAPK14MMP2CYP3A4
SCHEMBL920695 0.82 MAPK14 (0.55) MMP13SMN1; SMN2MAPK14MMP2CYP3A4
SCHEMBL12352377 0.82 MAPK14 (0.44) SMN1; SMN2MAPK14CYP3A4HTTALDH1A1
SCHEMBL1680835 0.81 LIPG (0.39) MAPK14CYP3A4ALDH1A1KDM4EMAPT
SCHEMBL1680856 0.81 ALDH1A1 (0.40) MMP13SMN1; SMN2MAPK14CYP3A4HTT
SCHEMBL1680806 0.79 KDM4E (0.38) ADORA2AALDH1A1HPGDKDM4EMAPT
SCHEMBL1680766 0.79 KLKB1 (0.38) MMP13SMN1; SMN2MAPK14CYP3A4HTT
SCHEMBL1680840 0.79 KLKB1 (0.39) SMN1; SMN2MAPK14HTTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101951771-A Composition for agricultural use for controlling or preventing plant diseases caused by plant pathogens SUMITOMO CHEMICAL CO 2011-01-19 CN 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

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 MMP13 4062/4885SMN1; SMN2 4796/4885MAPK14 905/4885

“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.