SCHEMBL28834072

SCHEMBL28834072

Cc1ccc(NC2CCN(C(=O)OC(C)(C)C)C2)c2cccnc12

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 7/20 0.51
BRD4 O60885 1/20 0.46
PIM1 P11309 2/20 0.46
PIM2 Q9P1W9 2/20 0.46
BTK Q06187 1/20 0.45
CNR1 P21554 2/20 0.45
PARP1 P09874 1/20 0.45
GPR119 Q8TDV5 2/20 0.44
PIK3CD O00329 1/20 0.44
EPHX2 P34913 1/20 0.44

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
SCHEMBL28834071 1.00 USP30 (0.51) USP30BRD4PIM1PIM2BTK
SCHEMBL29862617 1.00 USP30 (0.51) USP30BRD4PIM1PIM2BTK
SCHEMBL29862707 1.00 USP30 (0.51) USP30BRD4PIM1PIM2BTK
SCHEMBL28834225 1.00 USP30 (0.51) USP30BRD4PIM1PIM2BTK
SCHEMBL23359862 0.94 ALDH1A1 (0.49) USP30BRD4BTKCNR1GPR119
SCHEMBL28834014 0.92 USP30 (0.50) USP30BRD4PIM1PIM2BTK
SCHEMBL29933367 0.92 USP30 (0.50) USP30BRD4PIM1PIM2BTK
SCHEMBL28834013 0.92 USP30 (0.50) USP30BRD4PIM1PIM2BTK
SCHEMBL28834340 0.89 USP30 (0.50) USP30BRD4PIM1PIM2BTK
SCHEMBL28834031 0.89 USP30 (0.50) USP30BRD4PIM1PIM2BTK

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
CN-114867719-A Pyrrolidine and piperidine compounds 柳韩洋行 2022-08-05 CN disclosed