SCHEMBL921976

SCHEMBL921976

Nc1ncccc1C(=O)NCc1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.52
HTR2C P28335 1/20 0.51
EGLN1 Q9GZT9 1/20 0.50
KLKB1 P03952 1/20 0.50
KDR P35968 1/20 0.50
PDE2A O00408 1/20 0.49
EPHX2 P34913 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
MAPK14 Q16539 2/20 0.48
HDAC6 Q9UBN7 1/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KMT2A Q03164 1/20 0.46

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
SCHEMBL921833 0.93 MAPK14 (0.54) MAPK8HTR2CEGLN1KLKB1MAPK14
SCHEMBL920966 0.91 MAPK8 (0.46) MAPK8HTR2CEGLN1KLKB1KDR
SCHEMBL920254 0.91 MAPK14 (0.60) MAPK8HTR2CMAPK14HPGDKMT2A
SCHEMBL921381 0.90 MAPK8 (0.52) MAPK8EGLN1KLKB1HDAC6LMNA
SCHEMBL920722 0.89 MAPK14 (0.61) MAPK8MAPK14HDAC6LMNAHPGD
SCHEMBL919923 0.88 MAPK8 (0.45) MAPK8HTR2CEGLN1KLKB1KDR
SCHEMBL920035 0.88 MAPK8 (0.45) MAPK8HTR2CEGLN1KLKB1MAPK14
SCHEMBL921664 0.88 P2RX7 (0.47) MAPK8HTR2CEGLN1MAPK14HDAC6
SCHEMBL921412 0.88 MAPK8 (0.45) MAPK8HTR2CEGLN1KLKB1MAPK14
SCHEMBL920473 0.87 HPGD (0.57) MAPK8EGLN1LMNAHPGDSMN1; SMN2

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 MAPK8 2313/4885HTR2C 4348/4885EGLN1 430/4885

“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.