SCHEMBL7326888

SCHEMBL7326888

O=C(O)CN1CCC[C@H](NP(=O)(O)CC(Cc2ccccc2)NC(=O)c2ccccc2)C1=O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 17/20 0.52
MME P08473 2/20 0.52
PIN1 Q13526 1/20 0.43
CTRB1 P17538 1/20 0.42
ACE2 Q9BYF1 3/20 0.42

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
SCHEMBL7326895 1.00 ACE (0.52) ACEMMEPIN1CTRB1ACE2
SCHEMBL7322445 0.87 ACE (0.49) ACEMMEPIN1CTRB1
SCHEMBL7436607 0.77 ACE (0.43) ACEPIN1CTRB1
SCHEMBL7436611 0.77 ACE (0.43) ACEPIN1CTRB1
SCHEMBL7322451 0.77 ACE (0.47) ACEMMEPIN1CTRB1
SCHEMBL7322456 0.77 ACE (0.47) ACEMMEACE2
SCHEMBL11019134 0.77 ACE (0.57) ACEMMEACE2
SCHEMBL11019149 0.77 ACE (0.57) ACEMMEACE2
SCHEMBL7321699 0.77 ACE (0.58) ACEMME
SCHEMBL7321687 0.77 ACE (0.58) ACEMME

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