SCHEMBL16771055

SCHEMBL16771055

O=C(NS(=O)(=O)C1CC1)c1cc(C2CC2)c(OC[C@@H]2C[C@H]3CC[C@@H](C2)N3C(=O)OCc2ccccc2)cc1F

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 17/20 0.66
▸ SCN5A Q14524 3/20 0.63
▸ SCN7A Q01118 4/20 0.58

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
SCHEMBL21825478 1.00 SCN9A (0.66) SCN9ASCN5ASCN7A
SCHEMBL16771179 0.92 SCN7A (0.69) SCN9ASCN5ASCN7A
SCHEMBL16771253 0.92 SCN7A (0.69) SCN9ASCN5ASCN7A
SCHEMBL16770842 0.89 SCN9A (0.74) SCN9ASCN5A
SCHEMBL16771233 0.88 SCN7A (0.51) SCN9ASCN5ASCN7A
SCHEMBL17062145 0.88 SCN7A (0.51) SCN9ASCN5ASCN7A
SCHEMBL17061992 0.88 SCN7A (0.51) SCN9ASCN5ASCN7A
SCHEMBL17062146 0.88 SCN7A (0.51) SCN9ASCN5ASCN7A
SCHEMBL17061838 0.87 SCN9A (0.78) SCN9ASCN5ASCN7A
SCHEMBL16758837 0.83 SCN9A (0.76) SCN9ASCN5ASCN7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 — — US disclosed
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-03-30 — — US disclosed
US-9546164-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-01-17 — — US disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 — — US disclosed
WO-2015078374-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-06-04 — — 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 (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-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, RRM1 SCN9A 1669/4885SCN5A 640/4885SCN7A 1496/4885
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF C1R, SRR, PNISR SCN9A 505/4885SCN5A 631/4885SCN7A 258/4885

“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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