SCHEMBL921259

SCHEMBL921259

Nc1ncccc1C(=O)NCc1cccc(Oc2cccc(F)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
HPGD P15428 2/20 0.53
MAPK8 P45983 1/20 0.51
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
ROCK1 Q13464 2/20 0.48
KLKB1 P03952 1/20 0.46
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
RPS6KB1 P23443 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
SCHEMBL920670 0.93 MAPK8 (0.53) KMT2AHPGDMAPK8ALDH1A1KDM4E
SCHEMBL920269 0.93 MAPK8 (0.53) KMT2AHPGDMAPK8KLKB1
SCHEMBL1680406 0.90 MAPK8 (0.63) KMT2AHPGDMAPK8ALDH1A1KDM4E
SCHEMBL922542 0.90 ROCK1 (0.57) KMT2AHPGDALDH1A1KDM4EROCK1
SCHEMBL923100 0.89 HPGD (0.51) KMT2AHPGDMAPK8ALDH1A1KDM4E
SCHEMBL920802 0.88 MAPK14 (0.51) KMT2AHPGDMAPK8ALDH1A1KDM4E
SCHEMBL923196 0.88 GPR52 (0.49) KMT2AHPGDMAPK8ALDH1A1KDM4E
SCHEMBL920646 0.88 HPGD (0.59) KMT2AHPGDMAPK8ALDH1A1KDM4E
SCHEMBL920983 0.87 HPGD (0.67) KMT2AHPGDALDH1A1KDM4EUSP2
SCHEMBL920848 0.87 HPGD (0.53) KMT2AHPGDMAPK8ALDH1A1KDM4E

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 KMT2A 2469/4885HPGD 1273/4885MAPK8 2313/4885

“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.