SCHEMBL4597686

SCHEMBL4597686

CCCCCN1C(=O)C(c2ccc3c(c2)OCO3)c2cccc(F)c21

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 14/20 0.73
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL281597 0.84 SCN9A (1.00) SCN9A
SCHEMBL5431005 0.83 SCN9A (0.68) SCN9ACSNK2BCSNK2A1MEN1KMT2A
SCHEMBL4903741 0.80 SCN9A (0.73) SCN9A
SCHEMBL4596915 0.78 SCN9A (0.63) SCN9ACSNK2BCSNK2A1MEN1KMT2A
SCHEMBL561973 0.73 SCN9A (0.69) SCN9A
SCHEMBL4596851 0.71 SCN9A (0.75) SCN9A
SCHEMBL281769 0.71 SCN9A (0.75) SCN9AMEN1KMT2A
SCHEMBL282036 0.70 SCN9A (0.74) SCN9AMEN1KMT2A
SCHEMBL4597321 0.68 SCN9A (0.71) SCN9A
SCHEMBL4732218 0.68 SCN9A (0.67) SCN9AMEN1KMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US claimed
EP-1877378-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-01-16 EP disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US disclosed
WO-2006113864-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2006-10-26 WO 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-20070105820-A1 Oxindole compounds and their uses as therapeutic agents OPRL1, OPRK1, TRPV1 SCN9A 148/4885CSNK2B 1340/4885CSNK2A1 1176/4885

“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.