SCHEMBL11124347

SCHEMBL11124347

CC(CC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 15/20 0.81
▸ ACE2 Q9BYF1 7/20 0.81
▸ REN P00797 1/20 0.54
▸ LMNA P02545 1/20 0.53

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
SCHEMBL11124339 1.00 ACE (0.81) ACEACE2RENLMNA
SCHEMBL11279585 1.00 ACE (0.81) ACEACE2RENLMNA
SCHEMBL11121798 0.93 ACE (0.70) ACEACE2REN
SCHEMBL11121801 0.93 ACE (0.70) ACEACE2REN
SCHEMBL11124576 0.90 ACE (0.66) ACEACE2REN
SCHEMBL11124578 0.90 ACE (0.66) ACEACE2REN
SCHEMBL11280512 0.89 ACE (1.00) ACEACE2LMNA
Water SCHEMBL11123849 0.89 ACE (0.65) ACEACE2REN
SCHEMBL8268894 0.88 ACE (0.76) ACEACE2REN
SCHEMBL6979828 0.88 ACE (0.76) ACEACE2REN

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
EP-0045161-B1 AMIDES OF 4-OXO-5-AMIDOHEXANOIC ACID DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-03-14 — — EP disclosed
EP-0053017-A1 Amide derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-06-02 — — EP disclosed
EP-0045161-A1 Amides of 4-oxo-5-amidohexanoic acid derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-02-03 — — EP disclosed
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