SCHEMBL16770869

SCHEMBL16770869

CC(C)(C)OC(=O)c1cc(C2CC2)c(OCC2(F)CCNCC2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.49
SCN5A Q14524 3/20 0.45
SCN1A P35498 2/20 0.45
SCN2A Q99250 2/20 0.45
SCN8A Q9UQD0 2/20 0.45
CYP2C9 P11712 1/20 0.44
SCN7A Q01118 1/20 0.44

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
Hydrochloric Acid SCHEMBL16758826 0.99 SCN9A (0.48) SCN9ASCN5ASCN1ASCN2ASCN8A
SCHEMBL16448710 0.90 SCN9A (0.59) SCN9ASCN5A
SCHEMBL29028643 0.89 SCN9A (0.53) SCN9ASCN5ASCN1ASCN2ASCN8A
SCHEMBL18263305 0.86 SCN9A (0.51) SCN9ASCN5ASCN1ASCN2ASCN8A
SCHEMBL16759103 0.86 SCN9A (0.51) SCN9ASCN5ASCN1ASCN2ASCN8A
SCHEMBL18263319 0.85 SCN9A (0.51) SCN9ASCN5ASCN1ASCN2ASCN8A
SCHEMBL18243763 0.85 SCN9A (0.53) SCN9ASCN5ASCN1ASCN2ASCN8A
Hydrochloric Acid SCHEMBL18263271 0.84 SCN9A (0.52) SCN9ASCN5ASCN1ASCN2ASCN8A
Hydrochloric Acid SCHEMBL17423323 0.84 SCN9A (0.52) SCN9ASCN5ASCN1ASCN2ASCN8A
Tert-Butyl Formate SCHEMBL28078847 0.84 SCN9A (0.49) SCN9ASCN5ASCN1ASCN2ASCN8A

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 25 patents — showing the first 20. 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
US-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-04-01 US disclosed
US-20200108054-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-04-09 US disclosed
CN-105793238-B Substituted benzamides and methods of use thereof 基因泰克公司 2019-12-24 CN disclosed
US-10179767-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2019-01-15 US disclosed
US-10179767-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2019-01-15 US disclosed
EP-3297989-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2018-03-28 EP disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 US disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 US disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 US disclosed
US-9546164-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-01-17 US disclosed
WO-2016191312-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-12-01 WO disclosed
WO-2016191312-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-12-01 WO disclosed
US-20160340309-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-11-24 US disclosed
US-20160340309-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-11-24 US disclosed
US-20160340309-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-11-24 US disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 US disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 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 (5 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-10179767-B2 Substituted benzamides and methods of use thereof SCN7A, SCN2B, SCN5A SCN9A 12/4885SCN5A 3/4885SCN1A 4/4885
US-20160340309-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF SCN7A, SCN2B, SCN5A SCN9A 12/4885SCN5A 3/4885SCN1A 4/4885
US-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SULT2A1 SCN9A 1605/4885SCN5A 628/4885SCN1A 320/4885
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, RRM1 SCN9A 1669/4885SCN5A 640/4885SCN1A 413/4885
US-20200108054-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SULT2A1 SCN9A 1605/4885SCN5A 628/4885SCN1A 320/4885

“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.