SCHEMBL921492

SCHEMBL921492

Cc1ccc(C(=O)NCc2ccc(Oc3ccc(CCC(C)C)cc3)cc2)c(N)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.43
ADORA1 P30542 2/20 0.43
MAPK14 Q16539 2/20 0.41
MMP13 P45452 2/20 0.41
MMP2 P08253 1/20 0.41
CYP3A4 P08684 1/20 0.41
STAT3 P40763 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.41
CHRM4 P08173 2/20 0.40
FLT1 P17948 1/20 0.40
LRRK2 Q5S007 1/20 0.40
LIPG Q9Y5X9 1/20 0.39
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
IDH1 O75874 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 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
SCHEMBL919230 0.91 MMP13 (0.42) MAPK14MMP13CHRM4FLT1LRRK2
SCHEMBL922806 0.89 CARM1 (0.43) ADORA2AADORA1MAPK14HTTSMN1; SMN2
SCHEMBL922940 0.89 ADORA2A (0.44) ADORA2AADORA1MAPK14MMP13MMP2
SCHEMBL919835 0.88 LIPG (0.43) MAPK14MMP13MMP2CYP3A4STAT3
SCHEMBL921458 0.88 ADORA2A (0.45) ADORA2AADORA1MAPK14MMP13MMP2
SCHEMBL920695 0.87 MAPK14 (0.55) ADORA2AADORA1MAPK14MMP13MMP2
SCHEMBL920682 0.86 ADORA2A (0.44) ADORA2AADORA1MAPK14MMP13MMP2
SCHEMBL920235 0.86 EGLN1 (0.38) MAPK14MMP13MMP2CYP3A4STAT3
SCHEMBL919964 0.85 MAPK14 (0.57) ADORA2AADORA1MAPK14MMP13CYP3A4
SCHEMBL921286 0.85 ADORA2A (0.57) ADORA2AADORA1CYP3A4HTTSMN1; SMN2

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 ADORA2A 4433/4885ADORA1 3433/4885MAPK14 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.