SCHEMBL463264

SCHEMBL463264

CCOC(=O)[C@H]1CN(Cc2ccccc2)C[C@@H]1c1cc(C)ccn1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.45
ATM Q13315 1/20 0.42
ALDH1A1 P00352 2/20 0.41
CCR8 P51685 1/20 0.41
KDM4E B2RXH2 2/20 0.41
CHRM2 P08172 2/20 0.40
CHRM4 P08173 2/20 0.40
CHRM5 P08912 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40
S1PR5 Q9H228 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
SCHEMBL463263 1.00 USP30 (0.51) USP30L3MBTL1ATMALDH1A1CCR8
SCHEMBL7216580 0.88 USP30 (0.53) USP30L3MBTL1ATMALDH1A1KDM4E
SCHEMBL7216583 0.88 USP30 (0.53) USP30L3MBTL1ATMALDH1A1KDM4E
SCHEMBL7216590 0.88 USP30 (0.53) USP30L3MBTL1ATMALDH1A1KDM4E
SCHEMBL462318 0.88 S1PR5 (0.44) USP30ALDH1A1CHRM4S1PR5
SCHEMBL462319 0.88 S1PR5 (0.44) USP30ALDH1A1CHRM4S1PR5
SCHEMBL30682978 0.82 CCR5 (0.53) USP30L3MBTL1ATMCCR8KDM4E
SCHEMBL1896053 0.82 CCR5 (0.53) USP30L3MBTL1ATMCCR8KDM4E
SCHEMBL3449300 0.81 RORC (0.55) USP30L3MBTL1ATMALDH1A1CHRM2
SCHEMBL5839366 0.81 RORC (0.55) USP30L3MBTL1ATMALDH1A1CHRM2

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed