SCHEMBL15314979

SCHEMBL15314979

CN1C(=O)[C@@]2(COc3cc4c(cc32)OCO4)c2ccccc21

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.69
SCN7A Q01118 1/20 0.56
SCN5A Q14524 1/20 0.56
SCN2A Q99250 1/20 0.56
SCN8A Q9UQD0 1/20 0.56
SCN10A Q9Y5Y9 1/20 0.56
GAA P10253 1/20 0.50
TSHR P16473 1/20 0.50
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46

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
SCHEMBL282359 1.00 SCN9A (0.69) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2355930 0.92 SCN9A (0.59) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL15314973 0.92 SCN9A (0.59) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL12314671 0.86 SCN9A (0.53) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL10289485 0.85 SCN9A (0.51) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL280937 0.84 SCN9A (0.86) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL19562310 0.84 SCN9A (0.78) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL12314572 0.84 SCN9A (0.48) SCN9AGAATSHRMAPT
SCHEMBL15314943 0.84 SCN9A (0.48) SCN9AGAATSHRMAPT
SCHEMBL3326065 0.83 SCN9A (0.50) 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-20170066777-A1 ASYMMETRIC SYNTHESES FOR SPIRO-OXINDOLE COMPOUNDS USEFUL AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2017-03-09 US disclosed
US-9487535-B2 Asymmetric syntheses for spiro-oxindole compounds useful as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2016-11-08 US disclosed
US-20130274483-A1 ASYMMETRIC SYNTHESES FOR SPIRO-OXINDOLE COMPOUNDS USEFUL AS THERAPEUTIC AGENTS PACIRA PHARMACEUTICALS, INC. 2013-10-17 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 (2 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-20170066777-A1 ASYMMETRIC SYNTHESES FOR SPIRO-OXINDOLE COMPOUNDS USEFUL AS THERAPEUTIC AGENTS OPRK1, OPRL1, PKD2 SCN9A 51/4885SCN7A 29/4885SCN5A 22/4885
US-20130274483-A1 ASYMMETRIC SYNTHESES FOR SPIRO-OXINDOLE COMPOUNDS USEFUL AS THERAPEUTIC AGENTS OPRK1, OPRL1, PKD2 SCN9A 51/4885SCN7A 29/4885SCN5A 22/4885

“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.