SCHEMBL23638893

SCHEMBL23638893

CO[C@H]1CC[C@H](c2cc(C(F)(F)F)ccc2C)C[C@@H]1N(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 9/20 0.40
CHRNB2 P17787 2/20 0.36
CHRNA4 P43681 2/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
SLC6A4 P31645 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
HTR2A P28223 1/20 0.34
PNMT P11086 1/20 0.33
KDM1A O60341 1/20 0.32

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
SCHEMBL23140855 0.82 CHRNB2 (0.38) SCN9ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL23638876 0.78 SCN9A (0.47) SCN9ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL23639105 0.77 SCN9A (0.49) SCN9ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL25026228 0.77 CHRNB2 (0.47) CHRNB2CHRNA4CHRNB4CHRNA3HTR2A
SCHEMBL23639020 0.76 SCN9A (0.39) SCN9ACHRNB2CHRNA4SLC6A4PNMT
SCHEMBL23638945 0.74 SCN9A (0.41) SCN9A
SCHEMBL23639107 0.73 SCN9A (0.44) SCN9A
SCHEMBL25795120 0.70 TRPV1 (0.42) CHRNB2CHRNA4CHRNB4CHRNA3HTR2A
SCHEMBL23140998 0.70 SCN9A (0.45) SCN9ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL20063500 0.70 SCN9A (0.47) SCN9AHTR2A

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 34/4885CHRNB2 561/4885CHRNA4 563/4885

“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.