SCHEMBL921338

SCHEMBL921338

Nc1nc(F)ccc1C(=O)NCc1cccc(Oc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.54
PPARG P37231 9/20 0.52
PPARD Q03181 9/20 0.52
PPARA Q07869 9/20 0.52
CCR1 P32246 2/20 0.48
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
DHFR P00374 1/20 0.47
MLYCD O95822 1/20 0.46
KCNQ3 O43525 1/20 0.46
KCNQ2 O43526 1/20 0.46
MEN1 O00255 1/20 0.45
PLA2G1B P04054 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
GAA P10253 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL920920 0.93 MAPK14 (0.53) MAPK14PPARGPPARDPPARACCR1
SCHEMBL920201 0.93 MAPK14 (0.56) MAPK14PPARGPPARDPPARAKCNQ3
SCHEMBL920668 0.89 PPARG (0.56) MAPK14PPARGPPARDPPARACCR1
SCHEMBL920375 0.89 MAPK14 (0.51) MAPK14PPARGPPARDPPARAHPGD
SCHEMBL922825 0.88 MAPK14 (0.57) MAPK14PPARGPPARDPPARAHPGD
SCHEMBL921456 0.88 KDM4E (0.47) MAPK14PPARGPPARDPPARAHPGD
SCHEMBL920852 0.87 MAPK14 (0.59) MAPK14PPARGPPARDPPARAHPGD
SCHEMBL919388 0.87 MAPK14 (0.47) MAPK14PPARGPPARDPPARAHPGD
SCHEMBL921487 0.86 PPARG (0.51) MAPK14PPARGPPARDPPARALMNA
SCHEMBL922489 0.86 PPARG (0.47) PPARGPPARDPPARACCR1LMNA

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
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 MAPK14 905/4885PPARG 391/4885PPARD 360/4885

“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.