SCHEMBL920500

SCHEMBL920500

N#Cc1cccc(Oc2ccc(CNC(=O)c3ccc(F)nc3N)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.44
PDPK1 O15530 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KLKB1 P03952 2/20 0.42
KLK1 P06870 1/20 0.42
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
CNR2 P34972 1/20 0.41
AKR1B1 P15121 1/20 0.41
GALR3 O60755 1/20 0.39
NR2F2 P24468 1/20 0.39
MAPK14 Q16539 1/20 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
SCHEMBL919988 0.90 SCN9A (0.48) SCN9APDPK1KLKB1KLK1CNR2
SCHEMBL921767 0.89 KLKB1 (0.48) SCN9APDPK1SMN1; SMN2KLKB1KLK1
SCHEMBL919925 0.87 HTR2C (0.49) KLKB1HTR2CHTR2BGALR3NR2F2
SCHEMBL921469 0.86 MAPK14 (0.52) SMN1; SMN2KLKB1KLK1GALR3NR2F2
SCHEMBL920738 0.85 SCN9A (0.42) SCN9APDPK1SMN1; SMN2KLKB1KLK1
SCHEMBL920524 0.85 KDM4E (0.50) SMN1; SMN2
SCHEMBL920468 0.85 KLKB1 (0.49) KLKB1KLK1CNR2GALR3NR2F2
SCHEMBL922765 0.85 MAPK14 (0.47) SMN1; SMN2KLKB1GALR3NR2F2MAPK14
SCHEMBL922233 0.85 GALR3 (0.41) SMN1; SMN2KLKB1KLK1HTR2CHTR2B
SCHEMBL920047 0.85 HPGD (0.42) SMN1; SMN2KLKB1CNR2GALR3NR2F2

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 SCN9A 1203/4885PDPK1 1420/4885SMN1; SMN2 4796/4885

“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.