SCHEMBL224862

SCHEMBL224862

COC[C@@H](NCc1ccccc1)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA3 P07451 1/20 0.57
CA4 P22748 1/20 0.57
CA6 P23280 1/20 0.57
CA5A P35218 1/20 0.57
CA7 P43166 1/20 0.57
CACNA1C Q13936 1/20 0.57
SCN9A Q15858 1/20 0.57
CA9 Q16790 1/20 0.57
CA13 Q8N1Q1 1/20 0.57
CA14 Q9ULX7 1/20 0.57
CA5B Q9Y2D0 1/20 0.57
MAPT P10636 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TLR2 O60603 4/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PSMB5 P28074 1/20 0.44

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
SCHEMBL15671411 1.00 CA12 (0.57) CA12CA1CA2CA3CA4
SCHEMBL15670460 0.84 CA12 (0.74) CA12CA1CA2CA3CA4
SCHEMBL15670461 0.84 CA12 (0.74) CA12CA1CA2CA3CA4
SCHEMBL8514186 0.84 CA12 (0.74) CA12CA1CA2CA3CA4
SCHEMBL1576885 0.84 ITGA4 (0.43) CA12CA1CA2CA3CA4
SCHEMBL1576807 0.83 FOLH1 (0.49) CA1CA2CA7CA9
SCHEMBL30673429 0.82 MMP2 (0.41) CA12CA1CA2CA3CA4
SCHEMBL19450068 0.82 POLB (0.51) TLR2PSMB5
SCHEMBL5653982 0.80 PDCD1 (0.49)
SCHEMBL1576808 0.80 PDCD1 (0.49)

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853453-B2 Processes for reducing impurities in lacosamide RANBAXY LABORATORIES LIMITED (IN) 2014-10-07 US disclosed
US-20130204042-A1 PROCESSES FOR REDUCING IMPURITIES IN LACOSAMIDE RANBAXY LABORATORIES LIMITED (IN) 2013-08-08 US disclosed
US-20130085304-A1 PROCESSES FOR PREPARATION OF POLYMORPHIC FORMS OF LACOSAMIDE RANBAXY LABORATORIES LIMITED (IN) 2013-04-04 US disclosed
US-8378142-B2 Intermediate compounds and their use in preparation of lacosamide RANBAXY LABORATORIES LIMITED (IN) 2013-02-19 US disclosed
EP-2501674-A2 PROCESSES FOR PREPARATION OF POLYMORPHIC FORMS OF LACOSAMIDE Ranbaxy Laboratories Limited (IN) 2012-09-26 EP 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-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

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-20130204042-A1 PROCESSES FOR REDUCING IMPURITIES IN LACOSAMIDE HEXA, NPEPPS, RNPEP CA12 103/4885CA1 415/4885CA2 198/4885
US-20120004452-A1 INTERMEDIATE COMPOUNDS AND THEIR USE IN PREPARATION OF LACOSAMIDE HDAC2, HDAC5, SCN5A CA12 11/4885CA1 10/4885CA2 23/4885
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
US-20130085304-A1 PROCESSES FOR PREPARATION OF POLYMORPHIC FORMS OF LACOSAMIDE BDNF, FKBP1B, SCN5A CA12 321/4885CA1 46/4885CA2 104/4885

“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.