SCHEMBL21296523

SCHEMBL21296523

CN(C(=O)O)[C@H]1C[C@@H](c2cccc(C(F)(F)F)c2)CC[C@H]1NC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.42
KDM1A O60341 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL21294888 1.00 SCN9A (0.42) SCN9AKDM1AMAOB
SCHEMBL20063766 0.91 SCN9A (0.48) SCN9AKDM1AMAOB
SCHEMBL20072906 0.91 SCN9A (0.48) SCN9AKDM1AMAOB
SCHEMBL20063852 0.91 SCN9A (0.48) SCN9AKDM1AMAOB
SCHEMBL20063765 0.91 SCN9A (0.48) SCN9AKDM1AMAOB
SCHEMBL21306611 0.89 SCN9A (0.53) SCN9A
SCHEMBL28487575 0.89 SCN9A (0.53) SCN9A
SCHEMBL21306637 0.89 SCN9A (0.50) SCN9A
SCHEMBL29482015 0.89 SCN9A (0.50) SCN9A
SCHEMBL29482010 0.89 SCN9A (0.50) SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3759098-A1 PYRIDINE-SULFONAMIDE COMPOUNDS AND THEIR USE AGAINST PAIN AND RELATED CONDITIONS Genentech, Inc. (US) 2021-01-06 EP disclosed
WO-2019165290-A1 PYRIDINE-SULFONAMIDE COMPOUNDS AND THEIR USE AGAINST PAIN AND RELATED CONDITIONS GENENTECH, INC. (US) 2019-08-29 WO disclosed