SCHEMBL6535537

SCHEMBL6535537

Cc1ccc(OC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.49
LMNA P02545 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ALOX5AP P20292 3/20 0.48
FEN1 P39748 1/20 0.48
DPP4 P27487 1/20 0.47
FFAR1 O14842 1/20 0.46
CHEK2 O96017 1/20 0.45
HRH2 P25021 1/20 0.45
HRH1 P35367 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL14045135 1.00 GPR119 (0.49) GPR119LMNANPSR1ALOX5APFEN1
SCHEMBL4313795 0.98 FFAR1 (0.49) GPR119LMNANPSR1ALOX5APFEN1
SCHEMBL4313801 0.98 FFAR1 (0.49) GPR119LMNANPSR1ALOX5APFEN1
SCHEMBL4316198 0.98 FFAR1 (0.49) GPR119LMNANPSR1ALOX5APFEN1
SCHEMBL13808931 0.94 ALOX5AP (0.48) GPR119LMNANPSR1ALOX5APFEN1
SCHEMBL13808944 0.94 ALOX5AP (0.47) GPR119LMNANPSR1ALOX5APFEN1
SCHEMBL2889380 0.90 GPR119 (0.49) GPR119ALOX5APFEN1CHEK2HRH2
SCHEMBL6535548 0.90 GPR119 (0.49) GPR119ALOX5APFEN1DPP4FFAR1
SCHEMBL4326309 0.90 GPR119 (0.49) GPR119ALOX5APFEN1CHEK2HRH2
SCHEMBL4314692 0.90 GPR119 (0.49) GPR119ALOX5APFEN1CHEK2HRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242081-A4 CASPASES AND APOPTOSIS SMITHKLINE BEECHAM CORP (US) 2004-07-21 EP disclosed
EP-1242081-A1 CASPASES AND APOPTOSIS SmithKline Beecham Corporation (US) 2002-09-25 EP disclosed
US-6403792-B1 INHIBIT PRODUCTION OF CASPASE 3 AND 7 IN MAMMALS SMITHKLINE BEECHAM CORPORATION 2002-06-11 US disclosed
WO-2001022966-A1 CASPASES AND APOPTOSIS SMITHKLINE BEECHAM CORPORATION (US) 2001-04-05 WO disclosed