SCHEMBL4597182

SCHEMBL4597182

O=C1C(c2ccc3c(c2)OCO3)c2ccccc2N1Cc1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.64
GSK3B P49841 4/20 0.48
ADK P55263 3/20 0.48
TSHR P16473 2/20 0.47
PKM P14618 2/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CMA1 P23946 1/20 0.46
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.43
TP53 P04637 1/20 0.42
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PDE5A O76074 1/20 0.41

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
SCHEMBL4732218 0.92 SCN9A (0.67) SCN9AGSK3BADKTSHRPKM
SCHEMBL4597321 0.79 SCN9A (0.71) SCN9AGSK3BTSHRALDH1A1GAA
SCHEMBL281597 0.78 SCN9A (1.00) SCN9ATSHRALDH1A1GAAHPGD
SCHEMBL19734441 0.77 SCN9A (0.57) SCN9AGSK3BADKTSHRALDH1A1
SCHEMBL12470372 0.75 GSK3B (0.54) SCN9AGSK3BADKTSHRPKM
SCHEMBL12297902 0.72 MEN1 (0.49) GSK3BTSHRKMT2ASMN1; SMN2ALDH1A1
SCHEMBL28154336 0.71 CES2 (0.51) SCN9AGSK3BADKTSHRKMT2A
SCHEMBL281432 0.71 SIRT1 (0.46) SCN9AGSK3BADKTSHRKMT2A
SCHEMBL28153014 0.70 CES2 (0.50) SCN9AGSK3BADKTSHRKMT2A
SCHEMBL4597722 0.68 SCN9A (0.76) SCN9ATSHRKMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1877378-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-01-16 EP claimed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US claimed
WO-2006113864-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2006-10-26 WO claimed
WO-2008046083-A2 USE OF OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-04-17 WO disclosed
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 148/4885GSK3B 1367/4885ADK 1653/4885

“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.