SCHEMBL7364621

SCHEMBL7364621

CNCC(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 8/20 0.62
REN P00797 4/20 0.50
LMNA P02545 2/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP2C19 P33261 1/20 0.50
KDM4E B2RXH2 1/20 0.50
F2 P00734 1/20 0.50
LTA4H P09960 1/20 0.50
MAPT P10636 1/20 0.50
PEPD P12955 1/20 0.50
ALOX15 P16050 1/20 0.50
PTGS1 P23219 1/20 0.50
HTR2A P28223 1/20 0.50
PTGS2 P35354 1/20 0.50
HRH1 P35367 1/20 0.50
THPO P40225 1/20 0.50
PMP22 Q01453 1/20 0.50
ACE2 Q9BYF1 1/20 0.50
RAB9A P51151 1/20 0.49
MVD P53602 2/20 0.48

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
SCHEMBL12343757 0.86 ACE (0.46) ACE
SCHEMBL16656666 0.86 ACE (0.46) ACE
SCHEMBL12343829 0.86 ACE (0.46) ACE
SCHEMBL12809058 0.85 DPP4 (0.47) ACE
SCHEMBL21779485 0.85 DPP4 (0.47) ACE
SCHEMBL28913603 0.83 FAP (0.61) ACERENLMNAHSD17B10CYP2C19
SCHEMBL6376807 0.83 POLB (0.51) ACELMNAPEPDRAB9A
SCHEMBL13226115 0.83 ACE (0.44) ACE
SCHEMBL17057350 0.83 ACE (0.68) ACERENLMNAHSD17B10CYP2C19
SCHEMBL30015190 0.82 ACE (0.58) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4514391-A HYPOTENSIVE AGENTS; ANALGESICS E. R. SQUIBB & SONS, INC. (US) 1985-04-30 US disclosed
EP-0132304-A2 Hydroxy substituted peptide compounds E.R. Squibb & Sons, Inc. (US) 1985-01-30 EP disclosed
US-4432971-A HYPOTENSIVE AGENTS AND ANGIOTENSIN INHIBITION E. R. SQUIBB & SONS, INC. (US) 1984-02-21 US disclosed
EP-0071544-A1 Phosphonamidate compounds E.R. Squibb & Sons, Inc. (US) 1983-02-09 EP disclosed