SCHEMBL8740045

SCHEMBL8740045

C[C@H](NC(=O)OCc1ccccc1)P(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.60
ATM Q13315 1/20 0.57
PRTN3 P24158 2/20 0.56
ACE2 Q9BYF1 1/20 0.55
CTSK P43235 2/20 0.54
KYNU Q16719 1/20 0.54
CTRB1 P17538 2/20 0.54
ECE1 P42892 2/20 0.53
MME P08473 1/20 0.53
CTSL P07711 1/20 0.52
CTSS P25774 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
SCHEMBL4163321 1.00 ELANE (0.60) ELANEATMPRTN3ACE2CTSK
SCHEMBL11567174 1.00 ELANE (0.60) ELANEATMPRTN3ACE2CTSK
SCHEMBL11567663 0.90 CTSK (0.57) ELANEATMPRTN3CTSKECE1
SCHEMBL11030901 0.90 CTSK (0.57) ELANEATMPRTN3CTSKECE1
SCHEMBL11568471 0.90 CTSK (0.57) ELANEATMPRTN3CTSKECE1
SCHEMBL8587097 0.90 ELANE (0.59) ELANEATMPRTN3ACE2CTSK
SCHEMBL11305760 0.89 CTSK (0.56) ELANEPRTN3CTSKECE1MME
SCHEMBL6923368 0.87 KYNU (0.57) ELANEATMPRTN3ACE2CTSK
SCHEMBL6923362 0.87 KYNU (0.57) ELANEATMPRTN3ACE2CTSK
SCHEMBL11304013 0.87 CTSK (0.55) ELANECTSKKYNUCTSLCTSS

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
CN-1187360-C Phosphonic acid derivs, having carboxypeptidase B inhibitory activity MEIJI SEIKA KAISHA (JP) 2005-02-02 CN disclosed
CN-1373766-A Phosphonic acid derivatives having carboxypeptidase B inhibitory activity MEIJI SEIKA KAISHA (JP) 2002-10-09 CN disclosed
US-5703263-A USEFUL AS ANTIBIOTICS AND/OR AS INTERMEDIATES IN THE PREPARATION OF PHOSPHORUS-CONTAINING ANALOGS OF PEPTIDES MONSANTO COMPANY (US) 1997-12-30 US disclosed
US-5654462-A CATALYTIC HYDROGENATION OF OLEFINS; ANTIBIOTICS; ENZYME INHIBITOR MONSANTO COMPANY (US) 1997-08-05 US disclosed
US-5321153-A Asymetric hydrogenation MONSANTO COMPANY (US) 1994-06-14 US disclosed
US-4134972-A OLIGOPEPTIDES HOFFMANN-LA ROCHE INC. (US) 1979-01-16 US disclosed
US-4127649-A PEPTIDES HOFFMANN-LA ROCHE INC. (US) 1978-11-28 US disclosed
US-4100275-A PEPTIDES HOFFMANN-LA ROCHE INC. (US) 1978-07-11 US disclosed