SCHEMBL13306376

SCHEMBL13306376

O=C1N2CCCCCc3cccc(c32)C12COc1cc3c(cc12)OCO3

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.45
SCN7A Q01118 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN8A Q9UQD0 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
ALDH1A1 P00352 5/20 0.39
GAA P10253 1/20 0.39
CES1 P23141 2/20 0.36
USP2 O75604 1/20 0.34

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
SCHEMBL2427072 0.84 SCN9A (0.38) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2425438 0.83 SCN9A (0.46) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2431152 0.80 SCN9A (0.44) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2434034 0.79 ALDH1A1 (0.39) SCN9AALDH1A1GAACES1
SCHEMBL3343014 0.73 SCN9A (0.51) SCN9AALDH1A1GAACES1USP2
SCHEMBL3349347 0.72 ALDH1A1 (0.38) ALDH1A1GAACES1USP2
SCHEMBL281951 0.69 SCN9A (0.70) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2426206 0.69 SCN9A (0.45) SCN9ASCN7ASCN5ASCN2ASCN8A
Hydrochloric Acid SCHEMBL281534 0.69 SCN9A (0.68) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281665 0.68 SCN9A (0.73) SCN9ASCN7ASCN5ASCN2ASCN8A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160291-A1 TRICYCLIC SPIRO-OXINDOLE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2010-06-24 US disclosed
US-20100160291-A1 TRICYCLIC SPIRO-OXINDOLE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2010-06-24 US disclosed
WO-2008046046-A1 TRICYCLIC SPIRO-OXINDOLE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-04-17 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-20100160291-A1 TRICYCLIC SPIRO-OXINDOLE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS OPRK1, SCN3A, CACNA1A SCN9A 57/4885SCN7A 54/4885SCN5A 21/4885

“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.