SCHEMBL7364635

SCHEMBL7364635

CCOC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)c1cccnc1Sc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ACE P12821 5/20 0.45
LMNA P02545 1/20 0.45
KCNK3 O14649 1/20 0.44
PREP P48147 4/20 0.43
FAP Q12884 2/20 0.43
MEN1 O00255 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ATM Q13315 1/20 0.43
P2RY12 Q9H244 1/20 0.40
HTT P42858 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
SCHEMBL8476331 0.85 MAPK8 (0.52) ALDH1A1ACELMNAKCNK3PREP
SCHEMBL7369918 0.85 MAPK8 (0.52) ALDH1A1ACELMNAKCNK3PREP
SCHEMBL7363975 0.84 CYP2C19 (0.52) ALDH1A1SMN1; SMN2ACELMNAKCNK3
SCHEMBL7361372 0.84 ACE (0.45) ALDH1A1KMT2ASMN1; SMN2ACELMNA
SCHEMBL7368109 0.83 PREP (0.43) ALDH1A1SMN1; SMN2ACELMNAKCNK3
SCHEMBL7366700 0.77 ACE (0.50) ALDH1A1SMN1; SMN2ACELMNAPREP
SCHEMBL8720975 0.76 ACE (0.45) ALDH1A1SMN1; SMN2ACELMNAKCNK3
SCHEMBL7369394 0.76 SMYD3 (0.50) ALDH1A1SMN1; SMN2ACELMNAKCNK3
SCHEMBL7368017 0.76 ACE (0.47) ALDH1A1SMN1; SMN2ACELMNAKCNK3
SCHEMBL7366766 0.74 PREP (0.66) ALDH1A1SMN1; SMN2ACELMNAKCNK3

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-0500989-B1 N-(alpha-substituted-pyridinyl) carbonyl dipeptide antihypertensive agents LACER SA (ES) 1998-12-09 EP disclosed
US-5432159-A N-(α-substituted-pyridinyl)carbonyl dipeptide antihypertensive agents LACER S.A. (ES) 1995-07-11 US disclosed
WO-1992015608-A1 N-(α-SUBSTITUTED-PYRIDINYL)CARBONYL DIPEPTIDE ANTIHYPERTENSIVE AGENTS LACER S.A. (ES) 1992-09-17 WO disclosed
EP-0500989-A1 N-(alpha-substituted-pyridinyl) carbonyl dipeptide antihypertensive agents LACER, S.A. (ES) 1992-09-02 EP disclosed