SCHEMBL526571

SCHEMBL526571

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

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.60
CTSS P25774 5/20 0.59
CTSL P07711 5/20 0.59
CTSB P07858 3/20 0.59
ALDH1A1 P00352 1/20 0.57
ALOX15 P16050 1/20 0.57
TACR1 P25103 2/20 0.56
KYNU Q16719 1/20 0.56
PPARG P37231 1/20 0.54
PPARA Q07869 1/20 0.54
ITGB3 P05106 3/20 0.54
ITGA2B P08514 3/20 0.54

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
SCHEMBL1643831 1.00 CTSK (0.60) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL1643830 1.00 CTSK (0.60) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL4387860 0.91 CTSK (0.64) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL527103 0.91 CTSK (0.64) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL527104 0.91 CTSK (0.64) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL10997126 0.91 CASP1 (0.56) CTSKCTSSCTSLCTSB
SCHEMBL4393193 0.90 ITGB3 (0.52) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL4462027 0.89 PPARA (0.55) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL18277716 0.89 CTSK (0.57) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL22637150 0.89 KYNU (0.57) CTSKCTSSCTSLCTSBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118530297-A Ketone amide compound, preparation method and application thereof 四川大学 2024-08-23 CN disclosed
EP-3144295-A1 PROCESS FOR THE PREPARATION OF LACOSAMIDE Divi's Laboratories Limited (IN) 2017-03-22 EP disclosed
US-9447024-B1 Process for the preparation of lacosamide DIVI'S LABORATORIES LIMITED (IN) 2016-09-20 US disclosed
US-9447024-B1 Process for the preparation of lacosamide DIVI'S LABORATORIES LIMITED (IN) 2016-09-20 US disclosed
WO-2015042397-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2015-03-26 WO disclosed
US-8957252-B2 Process for preparation of lacosamide and some N-benzyl-propanamide intermediate derivatives INDOCO REMEDIES LIMITED (IN) 2015-02-17 US disclosed
US-8933065-B2 N-benzylamide substituted derivatives of 2-(acylamido)acetic acid and 2-(acylamido)propionic acids: potent neurological agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2015-01-13 US disclosed
US-8829226-B2 Lacosamide intermediate compound, preparation method thereof and use thereof ZHEJIANG JIUZHOU PHARMACEUTICAL CO., LTD (CN) 2014-09-09 US disclosed
EP-2598476-B1 PROCESS FOR PREPARATION OF LACOSAMIDE AND SOME N-BENZYL-PROPANAMIDE INTERMEDIATE DERIVATIVES INDOCO REMEDIES LTD (IN) 2014-07-02 EP disclosed
EP-2598476-B1 PROCESS FOR PREPARATION OF LACOSAMIDE AND SOME N-BENZYL-PROPANAMIDE INTERMEDIATE DERIVATIVES INDOCO REMEDIES LTD (IN) 2014-07-02 EP disclosed
US-20110319649-A1 Intermediate for producing lacosamide and a process for its preparation and conversion to lacosamide EUTICALS GMBH (DE) 2011-12-29 US disclosed
EP-2399901-A1 Intermediate for producing lacosamide and a process for its preparation and conversion to lacosamide Archimica GmbH (DE) 2011-12-28 EP disclosed
WO-2009145816-A2 NOVEL N-BENZYLAMIDE SUBSTITUTED DERIVATIVES OF 2-(ACYLAMIDO)ACETIC ACID AND 2-(ACYLAMIDO)PROPIONIC ACIDS: POTENT NEUROLOGICAL AGENTS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2009-12-03 WO disclosed
US-7297706-B2 Certain glycine derivatives as factor Xa inhibitors for use in the treatment of thrombotic disorders ELI LILLY AND COMPANY (US) 2007-11-20 US disclosed
US-20070072869-A1 CERTAIN GLYCINE DERIVATIVES AS FACTOR Xa INHIBITORS FOR USE IN THE TREATMENT OF THROMBOTIC DISORDERS WILEY MICHAEL R 2007-03-29 US disclosed
US-7078415-B2 Certain glycine derivatives as factor Xa inhibitors for use in the treatment of thrombotic disorders ELI LILLY AND COMPANY (US) 2006-07-18 US disclosed
EP-1455787-B1 CERTAIN GLYCINE DERIVATIVES AS FACTOR XA INHIBITORS FOR USE IN THE TREATMENT OF THROMBOTIC DISORDERS LILLY CO ELI (US) 2005-06-22 EP disclosed
US-20040249155-A1 Certain glycine derivatives as factor xa inhibitors for use in the treatment of thrombotic disorders ELI LILLY AND COMPANY 2004-12-09 US disclosed
EP-1455787-A1 CERTAIN GLYCINE DERIVATIVES AS FACTOR XA INHIBITORS FOR USE IN THE TREATMENT OF THROMBOTIC DISORDERS ELI LILLY AND COMPANY (US) 2004-09-15 EP disclosed
WO-2003049735-A1 CERTAIN GLYCINE DERIVATIVES AS FACTOR XA INHIBITORS FOR USE IN THE TREATMENT OF THROMBOTIC DISORDERS ELI LILLY AND COMPANY (US) 2003-06-19 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 (3 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-20040249155-A1 Certain glycine derivatives as factor xa inhibitors for use in the treatment of thrombotic disorders F2, F11, SERPINC1 CTSK 3754/4885CTSS 4083/4885CTSL 3420/4885
US-20110319649-A1 Intermediate for producing lacosamide and a process for its preparation and conversion to lacosamide NAAA, MEP1B, BCHE CTSK 1129/4885CTSS 809/4885CTSL 1047/4885
US-20070072869-A1 CERTAIN GLYCINE DERIVATIVES AS FACTOR Xa INHIBITORS FOR USE IN THE TREATMENT OF THROMBOTIC DISORDERS F2, F11, F12 CTSK 4056/4885CTSS 4251/4885CTSL 3535/4885

“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.