SCHEMBL22020141

SCHEMBL22020141

CCC(O)CN1CCC(CC(=O)Nc2cc(C(F)(F)F)ccn2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.61
RIOK2 Q9BVS4 1/20 0.44
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
AR P10275 1/20 0.41
SCN1A P35498 2/20 0.40
SCN5A Q14524 2/20 0.40
SCN9A Q15858 2/20 0.40
JAK2 O60674 1/20 0.40
TYK2 P29597 1/20 0.40
GSK3B P49841 2/20 0.40
MAPK14 Q16539 1/20 0.40
DYRK1A Q13627 1/20 0.40
FPR2 P25090 1/20 0.40
EPHX2 P34913 1/20 0.39
SYK P43405 1/20 0.39
BTK Q06187 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL22020136 0.91 USP30 (0.62) USP30RIOK2ALDH1A1GAAL3MBTL1
SCHEMBL4271035 0.89 USP30 (0.60) USP30RIOK2ALDH1A1GAAL3MBTL1
SCHEMBL16254222 0.79 USP30 (0.64) USP30RIOK2ALDH1A1GAAL3MBTL1
SCHEMBL22653435 0.76 USP30 (1.00) USP30
SCHEMBL29878272 0.76 USP30 (1.00) USP30
SCHEMBL16254943 0.74 RIOK2 (0.60) USP30RIOK2ALDH1A1GAAL3MBTL1
SCHEMBL12004497 0.74 USP30 (0.58) USP30RIOK2FFAR4EPHX2SYK
SCHEMBL6862768 0.74 USP30 (0.58) USP30RIOK2FFAR4EPHX2SYK
SCHEMBL12004494 0.74 USP30 (0.58) USP30RIOK2FFAR4EPHX2SYK
SCHEMBL23060730 0.70 RIOK2 (0.61) USP30RIOK2ALDH1A1GAAL3MBTL1

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
EP-3189839-B1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS PRAXIS PREC MEDICINES INC (US) 2020-05-20 EP disclosed