SCHEMBL8818258

SCHEMBL8818258

Cc1cccc(C)c1OCC(C)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 10/20 0.61
CYP2D6 P10635 3/20 0.61
LMNA P02545 3/20 0.61
SCN5A Q14524 3/20 0.61
SCN1A P35498 2/20 0.61
SCN9A Q15858 2/20 0.61
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 2/20 0.61
NFKB1 P19838 2/20 0.61
TSHR P16473 2/20 0.61
CYP2C9 P11712 1/20 0.61
KCNK3 O14649 1/20 0.61
CACNA1F O60840 1/20 0.61
KCNK2 O95069 1/20 0.61
GBA1 P04062 1/20 0.61
MAOA P21397 1/20 0.61
HTR2A P28223 1/20 0.61
SLC6A4 P31645 1/20 0.61
HTR2B P41595 1/20 0.61
SCN7A Q01118 1/20 0.61

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
Mexiletine SCHEMBL8819167 0.81 SCN4A (0.80) SCN4ACYP2D6LMNASCN5ASCN1A
Mexiletine SCHEMBL6518643 0.81 SCN4A (0.80) SCN4ACYP2D6LMNASCN5ASCN1A
SCHEMBL21834931 0.80 SCN4A (0.57) SCN4ACYP2D6LMNASCN5ASCN1A
Mexiletine SCHEMBL9953806 0.80 SCN4A (0.71) SCN4ACYP2D6LMNASCN5ASCN1A
Mexiletine SCHEMBL2719005 0.79 SCN4A (0.75) SCN4ACYP2D6LMNASCN5ASCN1A
Mexiletine SCHEMBL2721177 0.79 SCN4A (0.69) SCN4ACYP2D6LMNASCN5ASCN1A
Mexiletine SCHEMBL2718712 0.79 SCN4A (0.69) SCN4ACYP2D6LMNASCN5ASCN1A
SCHEMBL2560624 0.78 SRC (0.44) SCN4ACYP2D6LMNASCN5ASCN1A
Mexiletine SCHEMBL9955253 0.76 SCN4A (0.71) SCN4ACYP2D6LMNASCN5ASCN1A
SCHEMBL7701146 0.76 SCN4A (0.66) SCN4ACYP2D6LMNASCN5ASCN1A

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
WO-1997027169-A1 (2-DIMETHYLPHENOXY-1-METHYLETHYL) ETHYLAMINE F.HOFFMANN-LA ROCHE AG (CH) 1997-07-31 WO disclosed