SCHEMBL921235

SCHEMBL921235

Nc1nc(F)ccc1C(=O)NCc1ccc(Oc2cccc(C(F)(F)F)c2F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.42
PTGER2 P43116 1/20 0.42
CHEK2 O96017 1/20 0.42
MAPK14 Q16539 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RIPK1 Q13546 1/20 0.39
CNR2 P34972 1/20 0.39
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
RECQL P46063 1/20 0.38
ADORA2A P29274 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL920043 0.92 MAPK14 (0.45) PTGER4PTGER2MAPK14ALDH1A1GAA
SCHEMBL920641 0.91 PTGER4 (0.41) PTGER4PTGER2CHEK2MAPK14ALDH1A1
SCHEMBL920972 0.89 HTR2C (0.43) PTGER4PTGER2MAPK14ALDH1A1GAA
SCHEMBL922433 0.87 RXFP1 (0.41) PTGER4PTGER2CHEK2MAPK14ALDH1A1
SCHEMBL922098 0.86 MAPK8 (0.46) PTGER4PTGER2MAPK14ALDH1A1GAA
SCHEMBL921586 0.85 L3MBTL1 (0.46) PTGER4PTGER2MAPK14ALDH1A1GAA
SCHEMBL921057 0.84 L3MBTL1 (0.48) PTGER4PTGER2MAPK14ALDH1A1GAA
SCHEMBL920576 0.84 PPARG (0.46) MAPK14ALDH1A1HPGDRIPK1CNR2
SCHEMBL919953 0.83 MAPK14 (0.58) MAPK14HPGDHTTLIPGCYP3A4
SCHEMBL922230 0.82 MAPK14 (0.43) PTGER4PTGER2MAPK14RIPK1LIPG

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 PTGER4 3181/4885PTGER2 3111/4885CHEK2 4206/4885

“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.