SCHEMBL482961

SCHEMBL482961

C[C@H](N)C(=O)C(CCCN)[C@H](N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 5/20 0.44
GSR P00390 1/20 0.42
GABRR1 P24046 2/20 0.41
SLC7A5 Q01650 1/20 0.40
RNPEP Q9H4A4 1/20 0.37
LTA4H P09960 1/20 0.37
GLO1 Q04760 1/20 0.35
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34

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
SCHEMBL482963 1.00 CPB2 (0.44) CPB2GSRGABRR1SLC7A5RNPEP
SCHEMBL5615751 0.85 SLC1A2 (0.49) SLC7A5SLC1A3SLC1A2SLC1A1
SCHEMBL5280980 0.82 GSR (0.50) CPB2GSRGABRR1SLC7A5RNPEP
SCHEMBL7271506 0.82 GSR (0.50) CPB2GSRGABRR1SLC7A5RNPEP
SCHEMBL28011992 0.81 GSR (0.45) CPB2GSRGABRR1SLC7A5RNPEP
SCHEMBL20915027 0.79 GSR (0.44) CPB2GSRGABRR1RNPEPSLC1A3
SCHEMBL20915026 0.79 GSR (0.44) CPB2GSRGABRR1RNPEPSLC1A3
SCHEMBL8388344 0.79 GSR (0.47) CPB2GSRGABRR1SLC7A5RNPEP
SCHEMBL8497383 0.78 CPB2 (0.36) CPB2GSRGABRR1RNPEPLTA4H
SCHEMBL1373660 0.78 GSR (0.34) CPB2GSRGABRR1SLC7A5RNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030083380-A1 Method of using hydroxycarboxylic acids or related compounds for treating skin changes asociated with intrinsic and extrinsic aging YU RUEY J (US) 2003-05-01 US claimed
EP-0413528-B1 Amphoteric compositions and polymeric forms of alpha hydroxyacids, and their therapeutic use YU RUEY J (US) 1995-11-15 EP claimed
US-5091171-A Skin disorders IGI, INC. 1992-02-25 US claimed
EP-0413528-A1 Amphoteric compositions and polymeric forms of alpha hydroxyacids, and their therapeutic use Yu, Ruey J., Dr. (US) 1991-02-20 EP claimed
US-8124388-B2 Production of 3-hydroxypropionic acid using beta-alanine/pyruvate aminotransferase NOVOZYMES A/S (DK) 2012-02-28 US disclosed
EP-1706457-B1 PRODUCTION OF 3-HYDROXYPROPIONIC ACID USING BETA-ALANINE/PYRUVATE AMINOTRANSFERASE NOVOZYMES AS (DK) 2012-02-01 EP disclosed
US-8043841-B2 Nucleic acid molecules encoding alanine 2,3-aminomutases NOVOZYMES A/S (DK) 2011-10-25 US disclosed
US-20110183382-A1 METHODS AND COMPOSITIONS FOR PRODUCING CHEMICAL PRODUCTS FROM C. PHYTOFERMENTANS QTEROS, INC. (US) 2011-07-28 US disclosed
WO-2011081658-A2 METHODS AND COMPOSITIONS FOR PRODUCING CHEMICAL PRODUCTS FROM C. PHYTOFERMENTANTS QTEROS, INC. (US) 2011-07-07 WO disclosed
EP-2292749-A2 Alanine 2, 3 aminomutases Novozymes A/S (DK) 2011-03-09 EP disclosed
EP-2292750-A2 Alanine 2, 3 aminomutases Novozymes A/S (DK) 2011-03-09 EP disclosed
US-20110045573-A1 ALANINE 2, 3-AMINOMUTASE NOVOZYMES A/S 2011-02-24 US disclosed
US-5643961-A TREATMENT OF SKIN WITH COSMETICS TRISTRATA TECHNOLOGY, INC. (US) 1997-07-01 US disclosed
US-5637615-A ANTIAGING AGENT TRISTRATA TECHNOLOGY, INC. (US) 1997-06-10 US disclosed
US-5580563-A Multiple antigen peptide system having adjuvant properties, vaccines prepared therefrom and methods of use thereof ROCKEFELLER UNIVERSITY, THE 1996-12-03 US disclosed
EP-0413528-B1 Amphoteric compositions and polymeric forms of alpha hydroxyacids, and their therapeutic use YU RUEY J (US) 1995-11-15 EP disclosed
EP-0671162-A2 Amphoteric compositions and polymeric forms of alpha hydroxyacids, and their therapeutic use Yu, Ruey J., Dr. (US) 1995-09-13 EP disclosed
US-5385938-A application of mixtures containing hydroxyacetic acid(or its salts) to skin IGI, INC. 1995-01-31 US disclosed
WO-1993022343-A1 MULTIPLE ANTIGEN PEPTIDE SYSTEM HAVING ADJUVANT PROPERTIES AND VACCINES PREPARED THEREFROM THE ROCKFELLER UNIVERSITY (US) 1993-11-11 WO disclosed
US-5091171-A Skin disorders IGI, INC. 1992-02-25 US 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 (1 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-20110045573-A1 ALANINE 2, 3-AMINOMUTASE ALAD, AGXT, ABAT CPB2 126/4885GSR 2630/4885GABRR1 3489/4885

“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.