SCHEMBL3724792

SCHEMBL3724792

CC(C)(C)OC(=O)N1CC[C@@H](Nc2ccc(-n3ncc4ccccc43)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
MAPT P10636 4/20 0.50
NPC1 O15118 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
POLB P06746 1/20 0.49
USP30 Q70CQ3 3/20 0.48
THRB P10828 4/20 0.47
LMNA P02545 3/20 0.47
TP53 P04637 6/20 0.46
GPR119 Q8TDV5 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
BTK Q06187 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
SCHEMBL3724793 1.00 ALDH1A1 (0.51) ALDH1A1MAPTNPC1MAPK1HTT
SCHEMBL3720046 0.94 ALDH1A1 (0.58) ALDH1A1MAPTNPC1MAPK1HTT
SCHEMBL3724794 0.87 USP30 (0.56) POLBUSP30THRBLMNA
SCHEMBL4940990 0.87 USP30 (0.56) POLBUSP30THRBLMNA
SCHEMBL3671324 0.85 LMNA (0.46) MAPTPOLBUSP30THRBLMNA
SCHEMBL3727246 0.84 BRD4 (0.49) ALDH1A1MAPTNPC1MAPK1HTT
SCHEMBL3727248 0.84 BRD4 (0.49) ALDH1A1MAPTNPC1MAPK1HTT
SCHEMBL3720050 0.83 POLB (0.60) MAPTPOLBUSP30THRBLMNA
SCHEMBL3668808 0.81 LMNA (0.49) MAPTPOLBTHRBLMNATP53
SCHEMBL3671327 0.81 USP30 (0.66) USP30GPR119

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2155719-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS Wyeth LLC (US) 2010-02-24 EP disclosed
WO-2008147945-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-12-04 WO disclosed