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Sugi Predict / Compounds / SCHEMBL10779490

SCHEMBL10779490

SCHEMBL10779490

O=C(NC(CCc1ccccc1)CP(=O)(O)CC(=O)N1CCC[C@H]1C(=O)O)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 16/20 1.00
▸ ACE2 Q9BYF1 6/20 0.56

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
SCHEMBL10779271 0.90 ACE (1.00) ACEACE2
SCHEMBL10779265 0.90 ACE (1.00) ACEACE2
SCHEMBL11197216 0.90 ACE (0.98) ACEACE2
SCHEMBL10784691 0.89 ACE (0.80) ACEACE2
SCHEMBL10781977 0.88 ACE (0.78) ACEACE2
SCHEMBL10781971 0.88 ACE (0.78) ACEACE2
SCHEMBL10779298 0.86 ACE (0.78) ACEACE2
SCHEMBL10779293 0.86 ACE (0.78) ACEACE2
SCHEMBL10956777 0.85 ACE (1.00) ACEACE2
Lithium Ion SCHEMBL11197212 0.82 ACE (0.84) ACEACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4716155-A INHIBITORS OF ANGIOTENSIN-CONVERTING ENZYME E. R. SQUIBB & SONS, INC. (US) 1987-12-29 — — US disclosed
EP-0083172-B1 PHOSPHORUS CONTAINING COMPOUNDS E.R. Squibb & Sons, Inc. (US) 1987-09-16 — — EP disclosed
US-4555506-A Phosphorus containing compounds and use as hypotensives E. R. SQUIBB & SONS, INC. (US) 1985-11-26 — — US disclosed
EP-0083172-A2 Phosphorus containing compounds E.R. Squibb & Sons, Inc. (US) 1983-07-06 — — EP disclosed
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