SCHEMBL225196

SCHEMBL225196

COC[C@@H](NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CACNA1C Q13936 1/20 0.44
SCN9A Q15858 1/20 0.44
CA9 Q16790 1/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
KCNN4 O15554 3/20 0.43
NPSR1 Q6W5P4 1/20 0.41
PKLR P30613 1/20 0.41
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL8216038 0.88 KCNN4 (0.41) CA12CA1CA2CA3CA4
SCHEMBL2759895 0.83 CA12 (0.65) CA12CA1CA2CA3CA4
SCHEMBL225206 0.83 CA12 (0.65) CA12CA1CA2CA3CA4
SCHEMBL7656123 0.83 MTNR1A (0.45) NPSR1LMNAPPARGPPARA
SCHEMBL7656116 0.83 MTNR1A (0.45) NPSR1LMNAPPARGPPARA
SCHEMBL18555414 0.82 ALDH1A1 (0.38) KCNN4NPSR1PKLRMAPTALDH1A1
SCHEMBL2748097 0.82 ALDH1A1 (0.38) KCNN4NPSR1PKLRMAPTALDH1A1
SCHEMBL21837578 0.82 KDM4E (0.43) KDM4EALDH1A1LMNASMN1; SMN2TSHR
SCHEMBL21837576 0.82 KDM4E (0.43) KDM4EALDH1A1LMNASMN1; SMN2TSHR
SCHEMBL2742288 0.81 KCNN4 (0.46) KCNN4NPSR1ALDH1A1LMNAKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2067765-A2 Intermediate compounds and their use in preparation of lacosamide Ranbaxy Laboratories Limited (IN) 2009-06-10 EP claimed
US-20090143472-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2009-06-04 US claimed
EP-2444390-B1 Process for producing Lacosamide EUTICALS GMBH (DE) 2017-02-01 EP 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-8957252-B2 Process for preparation of lacosamide and some N-benzyl-propanamide intermediate derivatives INDOCO REMEDIES LIMITED (IN) 2015-02-17 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-8759582-B2 Process for the preparation of lacosamide NATCO PHARMA LIMITED (IN) 2014-06-24 US disclosed
EP-2598476-A1 PROCESS FOR PREPARATION OF LACOSAMIDE AND SOME N-BENZYL-PROPANAMIDE INTERMEDIATE DERIVATIVES Indoco Remedies Limited (IN) 2013-06-05 EP disclosed
US-20130123522-A1 PROCESS FOR PREPARATION OF LACOSAMIDE AND SOME N-BENZYL-PROPANAMIDE INTERMEDIATE DERIVATIVES INDOCO REMEDIES LIMITED (IN) 2013-05-16 US disclosed
US-20130123522-A1 PROCESS FOR PREPARATION OF LACOSAMIDE AND SOME N-BENZYL-PROPANAMIDE INTERMEDIATE DERIVATIVES INDOCO REMEDIES LIMITED (IN) 2013-05-16 US disclosed
WO-2012014226-A1 PROCESS FOR PREPARATION OF LACOSAMIDE AND SOME N-BENZYL-PROPANAMIDE INTERMEDIATE DERIVATIVES INDOCO REMEDIES LIMITED (IN) 2012-02-02 WO disclosed
US-8093426-B2 2-tritylamino-3-(hydroxy or methoxy)propionic acid, or corresponding benzylamide thereof as chemical intermediate; chirally pure lacosamide; high purity RANBAXY LABORATORIES LIMITED (IN) 2012-01-10 US disclosed
US-8093426-B2 2-tritylamino-3-(hydroxy or methoxy)propionic acid, or corresponding benzylamide thereof as chemical intermediate; chirally pure lacosamide; high purity RANBAXY LABORATORIES LIMITED (IN) 2012-01-10 US disclosed
US-20120004452-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE RANBAXY LABORATORIES LIMITED (IN) 2012-01-05 US disclosed
US-20120004462-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE RANBAXY LABORATORIES LIMITED (IN) 2012-01-05 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
EP-2067765-A2 Intermediate compounds and their use in preparation of lacosamide Ranbaxy Laboratories Limited (IN) 2009-06-10 EP disclosed
US-20090143472-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2009-06-04 US disclosed
US-20090143472-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2009-06-04 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 (4 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-20120004452-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE HDAC2, HDAC5, SCN5A CA12 11/4885CA1 10/4885CA2 23/4885
US-20130123522-A1 PROCESS FOR PREPARATION OF LACOSAMIDE AND SOME N-BENZYL-PROPANAMIDE INTERMEDIATE DERIVATIVES LPXN, CACNA1B, PMP22 CA12 138/4885CA1 78/4885CA2 119/4885
US-20120004462-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE HDAC2, HDAC5, SCN5A CA12 11/4885CA1 10/4885CA2 23/4885
US-20090143472-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE HDAC2, HDAC5, SCN5A CA12 11/4885CA1 10/4885CA2 23/4885

“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.