SCHEMBL7327929

SCHEMBL7327929

CCOC(=O)C(CCCCCCCN)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACE P12821 5/20 0.63
LMNA P02545 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL683530 0.99 ACE (0.64) ACELMNASMN1; SMN2
SCHEMBL7324077 0.94 ACE (0.59) ACELMNASMN1; SMN2
SCHEMBL7319770 0.92 ACE (0.68) ACELMNASMN1; SMN2
SCHEMBL7317912 0.92 ACE (0.68) ACELMNASMN1; SMN2
SCHEMBL7317388 0.92 ACE (0.68) ACELMNASMN1; SMN2
SCHEMBL7319777 0.92 ACE (0.68) ACELMNASMN1; SMN2
SCHEMBL7317915 0.92 ACE (0.68) ACELMNASMN1; SMN2
SCHEMBL7317394 0.92 ACE (0.68) ACELMNASMN1; SMN2
SCHEMBL7330553 0.91 ACE (0.69) ACELMNASMN1; SMN2
SCHEMBL7330560 0.91 ACE (0.69) ACELMNASMN1; SMN2

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-0279750-B1 AMINOACID DERIVATIVES AS ANTIHYPERTENSIVES Asahi Breweries, Ltd. (JP) 1993-01-20 EP disclosed