SCHEMBL921400

SCHEMBL921400

Nc1nc(F)ccc1C(=O)NCc1cccc(Oc2ccccc2I)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
USP2 O75604 1/20 0.46
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
PPARG P37231 6/20 0.41
PPARA Q07869 6/20 0.41
PPARD Q03181 5/20 0.41
MMP13 P45452 1/20 0.41
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TNIK Q9UKE5 1/20 0.40
MAPK14 Q16539 1/20 0.39
KCNQ3 O43525 2/20 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
SCHEMBL920663 0.90 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EUSP2CA2
SCHEMBL922774 0.89 L3MBTL1 (0.47) ALDH1A1HPGDCA2CA4GAA
SCHEMBL921634 0.88 HPGD (0.53) ALDH1A1HPGDKDM4EUSP2PPARG
SCHEMBL920829 0.88 HPGD (0.46) ALDH1A1HPGDKDM4EUSP2CA2
SCHEMBL920702 0.88 KDM4E (0.48) ALDH1A1HPGDKDM4EUSP2PPARG
SCHEMBL921270 0.88 KDM4E (0.48) ALDH1A1HPGDKDM4EUSP2CA2
SCHEMBL921510 0.88 MAPK14 (0.46) ALDH1A1HPGDKDM4EUSP2CA2
SCHEMBL920375 0.88 MAPK14 (0.51) ALDH1A1HPGDKDM4EUSP2CA2
SCHEMBL921768 0.87 MAPK14 (0.50) ALDH1A1HPGDKDM4EUSP2PPARG
SCHEMBL921571 0.87 HPGD (0.46) ALDH1A1HPGDKDM4EUSP2PPARG

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 ALDH1A1 2743/4885HPGD 1273/4885KDM4E 3657/4885

“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.