SCHEMBL22020136

SCHEMBL22020136

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.62
RIOK2 Q9BVS4 1/20 0.44
AR P10275 1/20 0.43
GSK3B P49841 2/20 0.42
DYRK1A Q13627 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
JAK2 O60674 1/20 0.41
TYK2 P29597 1/20 0.41
MAP3K12 Q12852 3/20 0.41
MAPK14 Q16539 1/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
BRAF P15056 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL22020141 0.91 USP30 (0.61) USP30RIOK2ARGSK3BDYRK1A
SCHEMBL4271035 0.90 USP30 (0.60) USP30RIOK2ARGSK3BDYRK1A
SCHEMBL16254222 0.80 USP30 (0.64) USP30RIOK2JAK2TYK2ALDH1A1
SCHEMBL22653435 0.76 USP30 (1.00) USP30
SCHEMBL29878272 0.76 USP30 (1.00) USP30
SCHEMBL12004497 0.75 USP30 (0.58) USP30RIOK2FFAR4MAP3K12MEN1
SCHEMBL12004494 0.75 USP30 (0.58) USP30RIOK2FFAR4MAP3K12MEN1
SCHEMBL6862768 0.75 USP30 (0.58) USP30RIOK2FFAR4MAP3K12MEN1
SCHEMBL16254943 0.72 RIOK2 (0.60) USP30RIOK2ARJAK2TYK2
SCHEMBL23060730 0.71 RIOK2 (0.61) USP30RIOK2ARALDH1A1GAA

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