SCHEMBL23639030

SCHEMBL23639030

CO[C@H]1CC[C@H](c2cccc(C(F)(F)F)c2)C[C@@H]1N1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 7/20 0.49
DRD2 P14416 1/20 0.46
HTR2C P28335 2/20 0.43
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL23639026 0.88 SCN9A (0.47) SCN9ADRD2HTR2CHRH3
SCHEMBL23638950 0.87 SCN9A (0.48) SCN9ADRD2HTR2C
SCHEMBL21294825 0.84 SCN9A (0.50) SCN9ADRD2HTR2C
SCHEMBL21306780 0.84 SCN9A (0.50) SCN9ADRD2HTR2C
SCHEMBL28487582 0.83 SCN9A (0.49) SCN9ADRD2HTR2C
SCHEMBL23140808 0.82 SCN9A (0.46) SCN9ADRD2HTR2C
SCHEMBL21306730 0.81 HTR2C (0.47) SCN9ADRD2HTR2C
SCHEMBL23140869 0.81 HTR2C (0.47) SCN9ADRD2HTR2C
Hydrochloric Acid SCHEMBL21294890 0.80 HTR2C (0.48) SCN9ADRD2HTR2C
SCHEMBL20063503 0.79 SCN9A (0.50) SCN9ADRD2HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210214336-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS GENENTECH, INC. (US) 2021-07-15 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-20210214336-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS SCN1B, CACNA1A, SCN1A SCN9A 34/4885DRD2 1985/4885HTR2C 1563/4885

“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.