SCHEMBL272347

SCHEMBL272347

CC(C)[C@H](N)C(=O)OC=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.44
SLC1A3 P43003 2/20 0.33
SLC1A2 P43004 2/20 0.33
SLC1A1 P43005 2/20 0.33
DPP4 P27487 2/20 0.33
FAP Q12884 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
LAP3 P28838 1/20 0.32
PSMB5 P28074 1/20 0.32
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30
GABRA5 P31644 2/20 0.30
GABRA3 P34903 2/20 0.30
GABRA2 P47869 2/20 0.30

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
SCHEMBL1461506 0.84 SLC1A3 (0.32) SLC7A5SLC1A3SLC1A2SLC1A1
SCHEMBL9323986 0.83 SLC7A5 (0.46) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Ammonia Solution, Strong SCHEMBL28494050 0.82 SLC1A3 (0.31) SLC7A5SLC1A3SLC1A2SLC1A1
SCHEMBL2720464 0.81 SLC7A5 (0.44) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
SCHEMBL2886770 0.80
SCHEMBL12211509 0.80
SCHEMBL25395192 0.79 SLC7A5 (0.42) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
SCHEMBL28859296 0.79 SLC7A5 (0.42) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
SCHEMBL28859298 0.79 SLC7A5 (0.42) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
SCHEMBL28442557 0.79 DPP4 (0.41) DPP4FAPDPP8DPP9DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115141131-A 3,4-diacetyl-2,5-dimethylpyrrole compound and preparation method and application thereof 湖北中烟工业有限责任公司 2022-10-04 CN disclosed
CN-113831391-A Dipeptide compound exerting rapid antidepressant effect and application thereof 南京医科大学 2021-12-24 CN disclosed
US-8133904-B2 Cannabinoid receptor antagonists/inverse agonists useful for treating obesity JENRIN DISCOVERY, INC. (US) 2012-03-13 US disclosed
WO-2011018771-A2 PROCESS FOR THE PREPARATION OF VALGANCICLOVIR HYDROCHLORIDE RANBAXY LABORATORIES LIMITED (IN) 2011-02-17 WO disclosed
CN-101795569-A Cannabinoid receptor antagonists/inverse agonists for the treatment of obesity JENRIN DISCOVERY 2010-08-04 CN disclosed
EP-2182807-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY Jenrin Discovery (US) 2010-05-12 EP disclosed
WO-2009033125-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2009-03-12 WO disclosed
US-20090069329-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY JENRIN DISCOVERY (US) 2009-03-12 US disclosed
EP-1210360-A4 COMPOUNDS USEFUL TO MIMIC PEPTIDE BETA-STRANDS UNIV CALIFORNIA (US) 2005-03-02 EP disclosed
EP-1210360-A1 COMPOUNDS USEFUL TO MIMIC PEPTIDE BETA-STRANDS The Regents of the University of California (US) 2002-06-05 EP disclosed
WO-2001014412-A1 COMPOUNDS USEFUL TO MIMIC PEPTIDE BETA-STRANDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-03-01 WO disclosed
US-6160122-A Process for the preparation of a disubstituted thiazole ABBOTT LABORATORIES (US) 2000-12-12 US disclosed
US-6022989-A Process for the preparation of an activated amino acid ABBOTT LABORATORIES (US) 2000-02-08 US disclosed
US-5955582-A FOR IMMUNOASSAY DIAGNOSIS AND MONITORING OF CONDITIONS LIKE DIABETES BECKMAN COULTER, INC. (US) 1999-09-21 US disclosed
EP-0854872-A1 PROCESS FOR THE PREPARATION OF A DISUBSTITUTED THIAZOLE Abbott Laboratories (US) 1998-07-29 EP disclosed
EP-0854862-A1 PROCESS FOR THE PREPARATION OF AN ACTIVATED AMINO ACID Abbott Laboratories (US) 1998-07-29 EP disclosed
WO-1998000393-A1 PROCESS FOR THE PREPARATION OF AN ACTIVATED AMINO ACID ABBOTT LABORATORIES (US) 1998-01-08 WO disclosed
WO-1998000410-A1 PROCESS FOR THE PREPARATION OF A DISUBSTITUTED THIAZOLE ABBOTT LABORATORIES (US) 1998-01-08 WO disclosed
EP-0044710-B1 SYNTHETIC PEPTIDE SPECIFIC ANTIGENIC DETERMINANT AND METHOD OF MANUFACTURING ANTIGENIC MATERIALS THEREFROM SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1986-04-02 EP disclosed
EP-0044710-A1 Synthetic peptide specific antigenic determinant and method of manufacturing antigenic materials therefrom SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1982-01-27 EP 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-20090069329-A1 CANNABINOID RECEPTOR ANTAGONISTS/INVERSE AGONISTS USEFUL FOR TREATING OBESITY CNR2, CNR1, GPR119 SLC7A5 4463/4885SLC1A3 2799/4885SLC1A2 2709/4885

“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.