SCHEMBL9166405

SCHEMBL9166405

CC(=N)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACE P12821 10/20 0.49
REN P00797 3/20 0.49
LMNA P02545 2/20 0.49
HSD17B10 Q99714 2/20 0.49
CYP2C19 P33261 1/20 0.49
KDM4E B2RXH2 1/20 0.49
F2 P00734 1/20 0.49
LTA4H P09960 1/20 0.49
MAPT P10636 1/20 0.49
PEPD P12955 1/20 0.49
ALOX15 P16050 1/20 0.49
PTGS1 P23219 1/20 0.49
HTR2A P28223 1/20 0.49
PTGS2 P35354 1/20 0.49
HRH1 P35367 1/20 0.49
THPO P40225 1/20 0.49
PMP22 Q01453 1/20 0.49
ACE2 Q9BYF1 1/20 0.49
RAB9A P51151 1/20 0.47

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
SCHEMBL8297626 0.85 ACE (0.56) ACERENLMNAHSD17B10CYP2C19
SCHEMBL2177815 0.85 ACE (0.51) ACERENLMNAHSD17B10CYP2C19
SCHEMBL2177826 0.85 ACE (0.51) ACERENLMNAHSD17B10CYP2C19
SCHEMBL5013232 0.81 ACE (0.49) ACERENLMNAHSD17B10CYP2C19
SCHEMBL109013 0.81 ACE (0.49) ACERENLMNAHSD17B10CYP2C19
SCHEMBL3931067 0.81 ACE (0.49) ACERENLMNAHSD17B10CYP2C19
N-Acetylproline SCHEMBL428477 0.80 ACE (0.54) ACERENLMNAHSD17B10CYP2C19
N-Acetylproline SCHEMBL358379 0.80 ACE (0.54) ACERENLMNAHSD17B10CYP2C19
N-Acetylproline SCHEMBL428476 0.80 ACE (0.54) ACERENLMNAHSD17B10CYP2C19
SCHEMBL6789463 0.80 ACE (0.47) ACERENLMNAHSD17B10CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5424454-A 2,2,-dichloropropionyl-L-proline CELGENE CORPORATION (US) 1995-06-13 US disclosed
WO-1994026771-A1 PROCESS FOR THE STEREOSELECTIVE PREPARATION OF L-ALANYL-L-PROLINE CELGENE CORPORATION (US) 1994-11-24 WO disclosed
US-5319098-A Hydrogenating an N-(1-iminoethylcarbonyl)proline using a metal hydrogenolysis catalyst and a pH of less than 4 CELGENE CORPORATION (US) 1994-06-07 US disclosed