SCHEMBL288170

SCHEMBL288170

N[C@H](CCC(=O)O)Cc1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.58
NAALAD2 Q9Y3Q0 1/20 0.55
ANPEP P15144 4/20 0.49
ENPEP Q07075 4/20 0.49
TAAR1 Q96RJ0 3/20 0.48
SLC6A2 P23975 1/20 0.48
S1PR2 O95136 1/20 0.48
S1PR1 P21453 1/20 0.48
S1PR3 Q99500 1/20 0.48
CA2 P00918 1/20 0.47
CAMK2A Q9UQM7 1/20 0.47
CPA3 P15088 1/20 0.46
OPRK1 P41145 1/20 0.45
SLC15A1 P46059 1/20 0.45

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
SCHEMBL29074770 1.00 SLC7A5 (0.58) SLC7A5NAALAD2ANPEPENPEPTAAR1
SCHEMBL932261 1.00 SLC7A5 (0.58) SLC7A5NAALAD2ANPEPENPEPTAAR1
SCHEMBL11473268 0.90 SLC7A5 (0.54) SLC7A5NAALAD2ANPEPENPEPTAAR1
SCHEMBL27608497 0.88 SLC7A5 (0.53) SLC7A5NAALAD2ANPEPENPEPTAAR1
SCHEMBL13438342 0.86 SLC7A5 (0.53) SLC7A5TAAR1SLC6A2CA2OPRK1
SCHEMBL10098450 0.86 SLC7A5 (0.53) SLC7A5TAAR1SLC6A2CA2OPRK1
SCHEMBL16103714 0.86 SLC7A5 (0.53) SLC7A5TAAR1SLC6A2CA2OPRK1
SCHEMBL288374 0.86 ANPEP (0.49) SLC7A5NAALAD2ANPEPENPEPS1PR2
SCHEMBL27999570 0.86 ANPEP (0.49) SLC7A5NAALAD2ANPEPENPEPS1PR2
SCHEMBL157500 0.85 CPA3 (0.62) SLC7A5NAALAD2ANPEPENPEPCPA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10017481-B2 Conformationally constrained, fully synthetic macrocyclic compounds POLYPHOR AG (CH) 2018-07-10 US claimed
EP-2836485-B1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2018-01-10 EP claimed
EP-2499148-B1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2017-01-18 EP claimed
US-9512139-B2 Conformationally constrained, fully synthetic macrocyclic compounds POLYPHOR AG (CH) 2016-12-06 US claimed
US-20150051183-A1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2015-02-19 US claimed
EP-2836485-A1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS Polyphor Ag (CH) 2015-02-18 EP claimed
EP-2462147-B1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2014-11-12 EP claimed
WO-2013139697-A1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2013-09-26 WO claimed
US-20120270881-A1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2012-10-25 US claimed
EP-2499148-A2 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS Polyphor Ag (CH) 2012-09-19 EP claimed
WO-2011014973-A2 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2011-02-10 WO claimed
EP-3697208-B1 HIGH-FIDELITY LONG-TERM STORAGE OF BIOLOGICAL MATERIAL CENTRE NAT RECH SCIENT (FR) 2026-04-22 EP disclosed
EP-4687443-A1 METHOD FOR FUNCTIONALISING A SOLID SUBSTRATE WITH A PEPTIDE CONJUGATE Genepep (FR) 2026-02-11 EP disclosed
US-12250944-B2 High-fidelity long-term storage of biological material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2025-03-18 US disclosed
US-20240350657-A1 SULFOMALEIMIDE-BASED LINKERS AND CORRESPONDING CONJUGATES PIERRE FABRE MEDICAMENT (FR) 2024-10-24 US disclosed
EP-2270025-A1 Solid phase peptide synthesis of peptide alcohols Centre National pour la Recherche Scientifique (CNRS) (FR) 2011-01-05 EP disclosed
WO-2010127704-A1 BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY POLYPHOR AG (CH) 2010-11-11 WO disclosed
WO-2010023295-A1 PIPECOLIC LINKER AND ITS USE FOR CHEMISTRY ON SOLID SUPPORT CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2010-03-04 WO disclosed
US-20080249030-A1 Age Inhibitors CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2008-10-09 US disclosed
CN-101268093-A Age inhibitors PHARMAMENS (FR) 2008-09-17 CN 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 (5 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-10017481-B2 Conformationally constrained, fully synthetic macrocyclic compounds CTSE, CTSB, CTSS SLC7A5 1084/4885NAALAD2 3159/4885ANPEP 220/4885
US-20120270881-A1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS KCNB1, KCNAB1, KCNMB1 SLC7A5 1849/4885NAALAD2 4867/4885ANPEP 3835/4885
US-20150051183-A1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS CTSE, CTSB, CTSS SLC7A5 1084/4885NAALAD2 3159/4885ANPEP 220/4885
US-20240350657-A1 SULFOMALEIMIDE-BASED LINKERS AND CORRESPONDING CONJUGATES STS, SULT1E1, CD44 SLC7A5 543/4885NAALAD2 1129/4885ANPEP 322/4885
US-20080249030-A1 Age Inhibitors CFH, XPA, XPNPEP1 SLC7A5 2318/4885NAALAD2 1241/4885ANPEP 506/4885

“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.