SCHEMBL9353151

SCHEMBL9353151

O=C(NCCCCC(OP(=O)(O)CCCCc1ccccc1)C(=O)OC(=O)[C@@H]1CCCN1)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 5/20 0.43
▸ DPP4 P27487 1/20 0.42
▸ DPP8 Q6V1X1 1/20 0.42
▸ DPP9 Q86TI2 1/20 0.42
▸ DPP7 Q9UHL4 1/20 0.42
▸ REN P00797 1/20 0.41

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
SCHEMBL9353372 0.99 ACE (0.43) ACEDPP4DPP8DPP9DPP7
SCHEMBL9353285 0.98 DPP8 (0.42) ACEDPP4DPP8DPP9DPP7
SCHEMBL9353532 0.96 ACE (0.40) ACEDPP4DPP8DPP9DPP7
SCHEMBL9357495 0.92 SIRT2 (0.41) DPP4DPP8DPP9DPP7REN
SCHEMBL9353588 0.92 SIRT2 (0.41) DPP4DPP8DPP9DPP7REN
SCHEMBL10430251 0.92 DPP8 (0.40) DPP4DPP8DPP9DPP7REN
SCHEMBL10430255 0.88 DPP8 (0.41) DPP4DPP8DPP9DPP7
SCHEMBL474142 0.86 ACE (0.58) ACE
SCHEMBL9353717 0.85 ACE (0.57) ACE
SCHEMBL9353731 0.85 DPP8 (0.42) ACEDPP4DPP8DPP9DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0350138-B1 Processes for preparing phosphonyl hydroxyacyl prolines SQUIBB & SONS INC (US) 1994-10-19 — — EP disclosed
EP-0229520-B1 ORALLY ACTIVE PHOSPHONYL HYDROXYACYL PROLINES AND PROCESSES FOR PREPARING PHOSPHONYL HYDROXYACYL PROLINES E.R. Squibb & Sons, Inc. (US) 1990-05-30 — — EP disclosed
US-4900860-A Process for preparing phosphonyloxyacyl amino acids E. R. SQUIBB & SONS, INC. (US) 1990-02-13 — — US disclosed
EP-0350138-A2 Processes for preparing phosphonyl hydroxyacyl prolines E.R. SQUIBB & SONS, INC. (US) 1990-01-10 — — EP disclosed
US-4885380-A REACTING PHOSPHONIC ACID DICHLORIDE WITH ALPHA-HYDROXY ACID TO FORM CYCLIC MIXED ANHYDRIDE; REACTING WITH AMINO ACID THOTTATHIL JOHN K (US) 1989-12-05 — — US disclosed
US-4745196-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1988-05-17 — — US disclosed
EP-0237264-A2 Process for preparing phosphonyloxyacyl amino acids and derivates thereof E.R. Squibb & Sons, Inc. (US) 1987-09-16 — — EP disclosed
EP-0229520-A1 Orally active phosphonyl hydroxyacyl prolines and processes for preparing phosphonyl hydroxyacyl prolines E.R. Squibb & Sons, Inc. (US) 1987-07-22 — — EP disclosed
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