SCHEMBL23159291

SCHEMBL23159291

CCOC(=O)c1cc(C2CC2)c(OCC(CO)CO)cc1F

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 0.44
▸ SCN5A Q14524 4/20 0.42
▸ SCN7A Q01118 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
SCHEMBL16770853 0.85 SCN9A (0.43) SCN9ASCN5ASCN7A
SCHEMBL16759396 0.84 SCN9A (0.46) SCN9ASCN5ASCN7A
SCHEMBL16759010 0.77 SCN9A (0.41) SCN9ASCN5ASCN7A
SCHEMBL17061985 0.75 SCN9A (0.45) SCN9ASCN5ASCN7A
SCHEMBL16759604 0.74 SCN9A (0.42) SCN9ASCN5A
SCHEMBL30261496 0.74 SCN9A (0.44) SCN9ASCN5A
SCHEMBL29391322 0.72 TSHR (0.50) —
SCHEMBL17061792 0.72 SCN9A (0.44) SCN9ASCN5ASCN7A
SCHEMBL16055163 0.72 CAMKK1 (0.44) SCN9A
SCHEMBL18682209 0.72 SCN9A (0.49) SCN9ASCN5A

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-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-04-01 — — 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-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SULT2A1 SCN9A 1605/4885SCN5A 628/4885SCN7A 1270/4885

“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.

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