SCHEMBL920459

SCHEMBL920459

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

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 2/20 0.55
ADORA2A P29274 1/20 0.53
ADORA1 P30542 1/20 0.53
CYP3A4 P08684 1/20 0.52
MAPK14 Q16539 1/20 0.52
PTGER4 P35408 4/20 0.51
SCN9A Q15858 1/20 0.51
PTGER2 P43116 2/20 0.49
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CHRM4 P08173 1/20 0.47
LMNA P02545 1/20 0.47
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47

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
SCHEMBL920695 0.91 MAPK14 (0.55) ADORA2AADORA1CYP3A4MAPK14HTT
SCHEMBL921155 0.89 ADORA2A (0.47) LIPGADORA2AADORA1CYP3A4MAPK14
SCHEMBL919964 0.89 MAPK14 (0.57) LIPGADORA2AADORA1CYP3A4MAPK14
SCHEMBL921286 0.89 ADORA2A (0.57) ADORA2AADORA1CYP3A4HTTSMN1; SMN2
SCHEMBL921861 0.89 MMP13 (0.48) MAPK14CHRM4PPARGPPARDPPARA
SCHEMBL921070 0.89 GCK (0.48) LIPGADORA2AADORA1MAPK14PTGER4
SCHEMBL921033 0.88 ADORA2A (0.53) ADORA2AADORA1CYP3A4MAPK14HTT
SCHEMBL919972 0.88 ADORA2A (0.46) LIPGADORA2AADORA1CYP3A4MAPK14
SCHEMBL922074 0.88 ADORA2A (0.46) LIPGADORA2AADORA1CYP3A4MAPK14
SCHEMBL921276 0.88 CYP3A4 (0.54) LIPGCYP3A4MAPK14PTGER4SCN9A

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
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
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 LIPG 3664/4885ADORA2A 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.