SCHEMBL4969263

SCHEMBL4969263

C=CCN1CCc2ccccc2[C@H](N)C1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.49
HTR1A P08908 2/20 0.45
SIGMAR1 Q99720 2/20 0.42
ANPEP P15144 2/20 0.41
ALDH1A1 P00352 1/20 0.38
HTR2A P28223 1/20 0.38
OPRM1 P35372 1/20 0.36
DRD1 P21728 2/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
DRD5 P21918 1/20 0.36

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
SCHEMBL4552272 1.00 PRCP (0.49) PRCPHTR1ASIGMAR1ANPEPALDH1A1
SCHEMBL4121058 0.81 PRCP (0.46) PRCPHTR1AANPEPALDH1A1HTR2A
SCHEMBL4116682 0.81 PRCP (0.46) PRCPHTR1AANPEPALDH1A1HTR2A
SCHEMBL4120258 0.81 PRCP (0.46) PRCPHTR1AANPEPALDH1A1HTR2A
SCHEMBL4128510 0.79 SIGMAR1 (0.48) SIGMAR1ANPEP
SCHEMBL4117548 0.79 SIGMAR1 (0.48) SIGMAR1ANPEP
SCHEMBL4117310 0.79 SIGMAR1 (0.48) SIGMAR1ANPEP
SCHEMBL4126331 0.73 XIAP (0.54) PRCPHTR1AANPEPHTR2AADRA2A
SCHEMBL4122465 0.73 XIAP (0.54) PRCPHTR1AANPEPHTR2AADRA2A
SCHEMBL4122057 0.73 XIAP (0.54) PRCPHTR1AANPEPHTR2AADRA2A

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-1345955-B1 LACTAM DIPEPTIDE AND ITS USE IN INHIBITING BETA-AMYLOID PEPTIDE RELEASE LILLY CO ELI (US) 2008-08-20 EP disclosed
EP-1353910-B1 LACTAM COMPOUND LILLY CO ELI (US) 2007-05-23 EP disclosed