SCHEMBL24740784

SCHEMBL24740784

CC(C)(C)OC(=O)N1CC2C[C@@H](Nc3cc(C4CC4)c(Cl)nn3)C[C@@H]2C1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.42
NR1H2 P55055 1/20 0.41
JAK1 P23458 3/20 0.39
JAK2 O60674 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CNR1 P21554 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 2/20 0.35
STS P08842 1/20 0.35
CDK9 P50750 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
TYK2 P29597 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL29919287 1.00 USP30 (0.42) USP30NR1H2JAK1JAK2ALDH1A1
SCHEMBL30367596 0.96 USP30 (0.41) USP30NR1H2JAK1JAK2ALDH1A1
SCHEMBL29919449 0.86 NR1H2 (0.46) USP30NR1H2JAK1JAK2ALDH1A1
SCHEMBL24575390 0.86 NR1H2 (0.46) USP30NR1H2JAK1JAK2ALDH1A1
SCHEMBL30367419 0.85 NR1H2 (0.43) USP30NR1H2JAK1JAK2ALDH1A1
SCHEMBL25260004 0.85 USP30 (0.46) USP30JAK1JAK2ALDH1A1MAPT
SCHEMBL25296607 0.85 USP30 (0.46) USP30JAK1JAK2ALDH1A1MAPT
SCHEMBL30488481 0.85 USP30 (0.46) USP30JAK1JAK2ALDH1A1MAPT
SCHEMBL23956997 0.84 NR1H2 (0.41) USP30NR1H2JAK1JAK2POLB
SCHEMBL30455542 0.84 NR1H2 (0.41) USP30NR1H2JAK1JAK2POLB

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-2022212819-A1 INDAZOLE DERIVATIVES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY (US) 2022-10-06 WO disclosed