SCHEMBL9622541

SCHEMBL9622541

NC(=O)C(Cc1ccccc1)CC(Cc1ccccc1)C(=O)N[C@H](CCc1ccccc1)C(=O)O

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.53
ACE P12821 2/20 0.53
CPA1 P15085 1/20 0.52
ACE2 Q9BYF1 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
SCHEMBL9622537 1.00 MME (0.53) MMEACECPA1ACE2
SCHEMBL9622589 0.91 NAALAD2 (0.62) MMEACE
SCHEMBL9622585 0.91 NAALAD2 (0.62) MMEACE
SCHEMBL9622475 0.81 FPR2 (0.52) MMEACECPA1ACE2
SCHEMBL9622480 0.81 FPR2 (0.52) MMEACECPA1ACE2
SCHEMBL30070551 0.81 ACE (0.56) MMEACECPA1ACE2
SCHEMBL8388193 0.80 NAALAD2 (0.61) MME
SCHEMBL28556221 0.80 MME (0.68) MMEACECPA1ACE2
SCHEMBL28556220 0.80 MME (0.68) MMEACECPA1ACE2
SCHEMBL9622623 0.79 NAALAD2 (0.69) MMEACE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5166212-A Hypotensive agents, analgesics CIBA-GEIGY CORPORATION (US) 1992-11-24 US disclosed
US-5021430-A Enkephalinase inhibitors, analgesics, hypotensives CIBA-GEIGY CORPORATION (US) 1991-06-04 US disclosed