SCHEMBL7332252

SCHEMBL7332252

CCOP(=O)(CCCCCCN1C(=O)c2ccccc2C1=O)NC1CCCN(CC(=O)O)C1=O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.42
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL7332240 1.00 ACE (0.42) ACEALDH1A1HPGDMAPK1LMNA
SCHEMBL7330364 0.85 ACE (0.55) ACE
SCHEMBL7330368 0.85 ACE (0.55) ACE
SCHEMBL7326265 0.83 TPSAB1 (0.42) ACE
SCHEMBL7322584 0.82 ACE (0.55) ACE
SCHEMBL7322575 0.82 ACE (0.55) ACE
SCHEMBL7431619 0.79 ALDH1A1 (0.37) ALDH1A1HPGDMAPK1LMNAMAPT
SCHEMBL11109004 0.79 ALDH1A1 (0.37) ALDH1A1HPGDMAPK1LMNAMAPT
SCHEMBL4445452 0.79 HPGD (0.54) ALDH1A1HPGDMAPK1
SCHEMBL7324994 0.78 ACE (0.47) ACE

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-4598071-A ANGIOTENSIN INHIBITORS/ E. R. SQUIBB & SONS, INC. (US) 1986-07-01 US disclosed
US-4567167-A INHIBITOR OF ANGIOTENDIN CONVERTING ENZYME E. R. SQUIBB & SONS, INC. (US) 1986-01-28 US disclosed
US-4533661-A Certain 3-phosphinyl-amino-2-oxo-1H-azepine-1-acetic acid derivatives having anti-hypertensive activity E. R. SQUIBB & SONS, INC. (US) 1985-08-06 US disclosed