SCHEMBL920986

SCHEMBL920986

Nc1ncccc1C(=O)NCc1ccc(Oc2cccc(OC(F)(F)F)c2F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.46
KMT2A Q03164 1/20 0.46
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
HPGD P15428 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTR2C P28335 1/20 0.43
EGFR P00533 1/20 0.43
BTK Q06187 1/20 0.43
PTGER4 P35408 1/20 0.42
PTGER2 P43116 1/20 0.42
KLKB1 P03952 1/20 0.42

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
SCHEMBL921381 0.92 MAPK8 (0.52) MAPK8KMT2AADORA2AADORA1HPGD
SCHEMBL920052 0.91 HPGD (0.46) MAPK8KMT2AADORA2AADORA1HPGD
SCHEMBL922098 0.89 MAPK8 (0.46) MAPK8KMT2AADORA2AHPGDALDH1A1
SCHEMBL921976 0.87 MAPK8 (0.52) MAPK8KMT2AHPGDEGLN1HDAC6
SCHEMBL920972 0.86 HTR2C (0.43) ADORA2AADORA1HPGDALDH1A1GAA
SCHEMBL919923 0.86 MAPK8 (0.45) MAPK8KMT2AHPGDALDH1A1GAA
SCHEMBL921412 0.86 MAPK8 (0.45) MAPK8KMT2AHPGDEGLN1HDAC6
SCHEMBL920035 0.86 MAPK8 (0.45) MAPK8KMT2AEGLN1HDAC6HTR2C
SCHEMBL921664 0.86 P2RX7 (0.47) MAPK8KMT2AHPGDEGLN1HDAC6
SCHEMBL919533 0.85 ADORA2A (0.42) ADORA2AADORA1HPGDALDH1A1GAA

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 MAPK8 2313/4885KMT2A 2469/4885ADORA2A 4433/4885

“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.