SCHEMBL15536247

SCHEMBL15536247

COC(=O)C1(C)CCC(C(F)(F)F)CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.33
NPSR1 Q6W5P4 1/20 0.32
FFAR3 O14843 1/20 0.32
MAPT P10636 1/20 0.32
MMP1 P03956 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL28066537 0.84 SCN9A (0.32) SCN9AFFAR3
SCHEMBL23547281 0.81 NPSR1 (0.32) SCN9ANPSR1MAPTMMP1
SCHEMBL1814154 0.80 NPSR1 (0.32) SCN9ANPSR1MAPTMMP1
SCHEMBL1814156 0.80 NPSR1 (0.32) SCN9ANPSR1MAPTMMP1
SCHEMBL1809492 0.80 NPSR1 (0.32) SCN9ANPSR1MAPTMMP1
SCHEMBL17002625 0.79 NPSR1 (0.31) NPSR1FFAR3MAPT
Hydrochloric Acid SCHEMBL1812451 0.79 NPSR1 (0.31) NPSR1MAPTMMP1
Hydrochloric Acid SCHEMBL1812447 0.79 NPSR1 (0.31) NPSR1MAPTMMP1
Hydrochloric Acid SCHEMBL1812449 0.79 NPSR1 (0.31) NPSR1MAPTMMP1
SCHEMBL6845298 0.79 FFAR3 (0.52) SCN9ANPSR1FFAR3MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2855428-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN Genentech, Inc. (US) 2015-04-08 EP disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 US disclosed
WO-2013177224-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN GENENTECH, INC. (US) 2013-11-28 WO disclosed