SCHEMBL4597668

SCHEMBL4597668

COc1ccc(OC)c(C2(O)C(=O)N(Cc3ccc(Cl)cc3)c3ccccc32)c1

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.80
TP53 P04637 4/20 0.52
MAPT P10636 2/20 0.52
THRB P10828 1/20 0.52
ALDH1A1 P00352 2/20 0.49
CHRM5 P08912 1/20 0.47
KMT2A Q03164 1/20 0.45

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
SCHEMBL4597208 0.89 SCN9A (1.00) SCN9ATP53MAPTTHRBALDH1A1
SCHEMBL4597672 0.85 SCN9A (1.00) SCN9ATP53MAPTTHRBALDH1A1
SCHEMBL4595619 0.84 SCN9A (1.00) SCN9ATP53MAPTTHRBALDH1A1
SCHEMBL4625797 0.84 SCN9A (1.00) SCN9ATP53MAPTTHRBALDH1A1
SCHEMBL12470272 0.78 SCN9A (0.60) SCN9ATP53MAPTCHRM5
SCHEMBL4597656 0.77 SCN9A (0.60) SCN9ATP53MAPTTHRBALDH1A1
SCHEMBL4597269 0.77 SCN9A (0.77) SCN9ACHRM5
SCHEMBL20988966 0.76 SCN9A (0.83) SCN9ATP53MAPTCHRM5
SCHEMBL4595935 0.76 SCN9A (1.00) SCN9ATP53MAPTTHRBALDH1A1
SCHEMBL5439177 0.76 SCN9A (0.49) SCN9ATP53MAPTCHRM5

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 7 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
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

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 148/4885TP53 4519/4885MAPT 1540/4885

“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.