SCHEMBL7328702

SCHEMBL7328702

O=C(NC(Cc1ccccc1)P(=O)(O)O)OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 10/20 0.63
MME P08473 10/20 0.63
F2 P00734 2/20 0.62
PLAU P00749 2/20 0.62
PLAT P00750 2/20 0.62
ACE2 Q9BYF1 1/20 0.60
CTRB1 P17538 2/20 0.59
PLG P00747 1/20 0.58

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
SCHEMBL14334539 1.00 ECE1 (0.63) ECE1MMEF2PLAUPLAT
SCHEMBL2242657 0.89 F2 (0.55) ECE1MMEF2PLAUPLAT
SCHEMBL7291199 0.89 ECE1 (0.61) ECE1MMEF2PLAUPLAT
SCHEMBL2249423 0.88 F2 (0.77) ECE1MMEF2PLAUPLAT
SCHEMBL15397886 0.87 ACE2 (0.56) ECE1MMEF2PLAUPLAT
SCHEMBL14334693 0.87 F2 (0.56) ECE1MMEF2PLAUPLAT
SCHEMBL7397375 0.86 ECE1 (0.59) ECE1MMEF2PLAUPLAT
SCHEMBL2244756 0.86 F2 (0.59) ECE1MMEF2PLAUPLAT
SCHEMBL15397862 0.86 ACE2 (0.71) ECE1MMEACE2
SCHEMBL7397171 0.85 F2 (0.69) ECE1MMEF2PLAUPLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2676962-A1 Derivatives of 1-aminoalkylphosphonate diaryl esters, method of 1-aminoalkylphosphonate diaryl ester derivatives preparation and their application Universität Ulm (DE) 2013-12-25 EP disclosed
EP-0352000-A2 Retroviral protease binding peptides SMITHKLINE BEECHAM CORPORATION (US) 1990-01-24 EP disclosed
US-4849414-A HYPOTENSIVE E. R. SQUIBB & SONS, INC. (US) 1989-07-18 US disclosed
EP-0249445-A2 Substituted aminoalkanoylaminoalkyl phosphonate angiotensin converting enzyme inhibitors E.R. Squibb & Sons, Inc. (US) 1987-12-16 EP disclosed
EP-0245942-A2 Process for preparing phosphonic acids E.R. Squibb & Sons, Inc. (US) 1987-11-19 EP disclosed
US-4670193-A OXIDATION E. R. SQUIBB & SONS, INC. (US) 1987-06-02 US disclosed