SCHEMBL921891

SCHEMBL921891

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.45
ADORA2A P29274 2/20 0.42
ADORA1 P30542 1/20 0.42
MMP13 P45452 2/20 0.41
GALR3 O60755 1/20 0.41
NR2F2 P24468 1/20 0.41
CHRM4 P08173 3/20 0.41
FLT1 P17948 1/20 0.41
LRRK2 Q5S007 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
USP2 O75604 1/20 0.40
KLKB1 P03952 1/20 0.40
PPARG P37231 3/20 0.40
PPARD Q03181 3/20 0.40
PPARA Q07869 3/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL919977 0.93 HPGD (0.48) MMP13CHRM4KDM4EALDH1A1HPGD
SCHEMBL919826 0.90 MMP13 (0.48) MAPK14MMP13CHRM4KDM4EALDH1A1
SCHEMBL920420 0.90 MAPK14 (0.49) MAPK14ADORA2AADORA1MMP13GALR3
SCHEMBL919972 0.89 ADORA2A (0.46) MAPK14ADORA2AADORA1MMP13GALR3
SCHEMBL920890 0.89 MMP13 (0.52) MAPK14ADORA2AADORA1MMP13CHRM4
SCHEMBL919964 0.88 MAPK14 (0.57) MAPK14ADORA2AADORA1MMP13GALR3
SCHEMBL919767 0.88 MMP13 (0.46) MAPK14MMP13CHRM4FLT1LRRK2
SCHEMBL922233 0.88 GALR3 (0.41) MAPK14MMP13GALR3NR2F2ALDH1A1
SCHEMBL920516 0.88 MAPK14 (0.45) MAPK14ADORA2AADORA1MMP13GALR3
SCHEMBL921070 0.88 GCK (0.48) MAPK14ADORA2AADORA1CHRM4KLKB1

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 MAPK14 905/4885ADORA2A 4433/4885ADORA1 3433/4885

“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.