SCHEMBL5492842

SCHEMBL5492842

COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.66
CAPN1 P07384 2/20 0.59
MMP2 P08253 2/20 0.58
MMP1 P03956 1/20 0.58
MMP3 P08254 1/20 0.58
LTA4H P09960 1/20 0.56
MMP7 P09237 1/20 0.56
MMP9 P14780 1/20 0.56
MMP12 P39900 1/20 0.56
MMP13 P45452 1/20 0.56
REN P00797 1/20 0.55

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
SCHEMBL7772111 1.00 MME (0.66) MMECAPN1MMP2MMP1MMP3
SCHEMBL24534148 0.90 MME (0.61) MME
SCHEMBL24534147 0.90 MME (0.61) MME
SCHEMBL7266645 0.89 CAPN1 (0.62) MMECAPN1
SCHEMBL9831181 0.89 CAPN1 (0.74) MMECAPN1
SCHEMBL29483597 0.89 CAPN1 (0.74) MMECAPN1
SCHEMBL21219352 0.89 CAPN1 (0.74) MMECAPN1
SCHEMBL21219351 0.89 CAPN1 (0.74) MMECAPN1
SCHEMBL21219280 0.89 CAPN1 (0.74) MMECAPN1
SCHEMBL4320484 0.89 CAPN1 (0.74) MMECAPN1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030012817-A1 Oral drug delivery compositions and methods EMISPHERE TECHNOLOGIES, INC. 2003-01-16 US claimed
US-20020052422-A1 Oral drug delivery compositions and methods EMISPHERE TECHNOLOGIES, INC. 2002-05-02 US claimed
EP-0696208-B1 ORAL DRUG DELIVERY COMPOSITIONS EMISPHERE TECH INC (US) 2001-08-22 EP claimed
US-5766633-A MODIFIED AMINO ACID CARRIER, BIOACTIVE PEPTIDES EMISPHERE TECHNOLOGIES, INC. (US) 1998-06-16 US claimed
EP-0696208-A4 ORAL DRUG DELIVERY COMPOSITIONS AND METHODS EMISPHERE TECH INC (US) 1997-01-29 EP claimed
EP-0696208-A1 ORAL DRUG DELIVERY COMPOSITIONS AND METHODS Emisphere Technologies, Inc. (US) 1996-02-14 EP claimed
WO-1994023767-A1 ORAL DRUG DELIVERY COMPOSITIONS AND METHODS EMISPHERE TECHNOLOGIES, INC. (US) 1994-10-27 WO claimed
US-20070197437-A1 COMPOSITIONS FOR ENHANCED EPITHELIAL PERMEATION OF Y2 RECEPTOR-BINDING PEPTIDES NASTECH PHARMACEUTICAL COMPANY INC. 2007-08-23 US disclosed
US-20070161563-A1 A DEVICE FOR ENHANCED EPITHELIAL PERMEATION OF Y2 RECEPTOR-BINDING PEPTIDES NASTECH PHARMACEUTICAL COMPANY INC. 2007-07-12 US disclosed
US-7229966-B2 Compositions and methods for enhanced mucosal delivery of Y2 receptor-binding peptides and methods for treating and preventing obesity NASTECH PHARMACEUTICAL COMPANY INC. (US) 2007-06-12 US disclosed
US-20070129299-A1 COMPOSITIONS AND METHODS FOR ENHANCED MUCOSAL DELIVERY OF PYY PEPTIDE NASTECH PHARMACEUTICAL COMPANY INC. 2007-06-07 US disclosed
US-7186691-B2 Compositions and methods for enhanced mucosal delivery of Y2 receptor-binding peptides and methods for treating and preventing obesity NASTECH PHARMACEUTICAL COMPANY INC. (US) 2007-03-06 US disclosed
US-7157426-B2 such as peptide YY, Neuropeptide Y, or Pancreatic polypeptide with solubilizing agent (cyclodextran), chelating agent (ethylenediamine tetraacetic acid), and polyol such as sucrose NASTECH PHARMACEUTICAL COMPANY INC. (US) 2007-01-02 US disclosed
EP-1077070-A2 Oral drug delivery compositions Emisphere Technologies, Inc. (US) 2001-02-21 EP disclosed
EP-1025840-A2 Oral drug compositions and methods Emisphere Technologies, Inc. (US) 2000-08-09 EP disclosed
US-5792451-A AMINO ACID DERIVATIVES AS CARRIERS FOR SENSITIVE AGENTS SUCH AS BIOACTIVE PEPTIDES EMISPHERE TECHNOLOGIES, INC. (US) 1998-08-11 US disclosed
US-5766633-A MODIFIED AMINO ACID CARRIER, BIOACTIVE PEPTIDES EMISPHERE TECHNOLOGIES, INC. (US) 1998-06-16 US disclosed
EP-0696208-A4 ORAL DRUG DELIVERY COMPOSITIONS AND METHODS EMISPHERE TECH INC (US) 1997-01-29 EP disclosed
EP-0696208-A1 ORAL DRUG DELIVERY COMPOSITIONS AND METHODS Emisphere Technologies, Inc. (US) 1996-02-14 EP disclosed
WO-1994023767-A1 ORAL DRUG DELIVERY COMPOSITIONS AND METHODS EMISPHERE TECHNOLOGIES, INC. (US) 1994-10-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030012817-A1 Oral drug delivery compositions and methods PTMS, ADM2, DNPEP MME 95/4885CAPN1 2406/4885MMP2 1368/4885
US-20020052422-A1 Oral drug delivery compositions and methods ADM2, PTMS, DNPEP MME 106/4885CAPN1 1942/4885MMP2 1266/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.