SCHEMBL24447495

SCHEMBL24447495

CCC[C@H](N)C(=O)N1CCC[C@H](C(=O)O)C1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.51
ITGB3 P05106 3/20 0.49
ITGA2B P08514 3/20 0.49
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
DPP7 Q9UHL4 4/20 0.43
FAP Q12884 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 1/20 0.43
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
ARG1 P05089 1/20 0.39
XPNPEP2 O43895 1/20 0.39
ACE P12821 1/20 0.39

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
SCHEMBL3718155 0.84 SMN1; SMN2 (0.46) LMNASMN1; SMN2ALDH1A1MAPK1XPNPEP2
SCHEMBL6824681 0.81 DPP4 (0.50) DPP4DPP7FAPDPP8DPP9
SCHEMBL14024791 0.79 DPP4 (0.51) DPP4DPP7FAPDPP8DPP9
SCHEMBL12430299 0.78 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1MAPK1XPNPEP2ACE
SCHEMBL21431189 0.78 DPP4 (0.48) DPP4ITGB3ITGA2BDPP7DPP8
SCHEMBL8177559 0.77 HPGD (0.52) SMN1; SMN2ALDH1A1
SCHEMBL6954395 0.77 XPNPEP2 (0.43) LMNASMN1; SMN2ALDH1A1MAPK1XPNPEP2
SCHEMBL7068510 0.77 XPNPEP2 (0.43) LMNASMN1; SMN2ALDH1A1MAPK1XPNPEP2
SCHEMBL6954392 0.77 XPNPEP2 (0.43) LMNASMN1; SMN2ALDH1A1MAPK1XPNPEP2
SCHEMBL20839142 0.76 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1MAPK1XPNPEP2ACE

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
EP-3774843-B1 DIPEPTIDE PIPERIDINE DERIVATIVES MOLECURE SA (PL) 2022-05-25 EP disclosed