SCHEMBL1697358

SCHEMBL1697358

O=C(N[C@H](CO)C(=O)NCc1ccccc1)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.60
CTSK P43235 5/20 0.60
CTSL P07711 4/20 0.60
CTSB P07858 3/20 0.60
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
HTT P42858 1/20 0.56
PSMB1 P20618 1/20 0.55
TACR1 P25103 2/20 0.54
MMP8 P22894 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
TSHR P16473 1/20 0.54
CYP2C19 P33261 1/20 0.54
GLS O94925 1/20 0.53
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52

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
SCHEMBL2120048 1.00 CTSS (0.60) CTSSCTSKCTSLCTSBGAA
SCHEMBL993635 0.93 CTSS (0.56) CTSSCTSKCTSLCTSBGAA
SCHEMBL7762796 0.89 CTSL (0.74) CTSSCTSKCTSLCTSBGAA
SCHEMBL7348355 0.88 FNTA (0.61) CTSSCTSKCTSLCTSBGAA
SCHEMBL7540842 0.88 CTSS (0.58) CTSSCTSKCTSLCTSBTACR1
SCHEMBL13584223 0.88 MMP8 (0.56) CTSSCTSKCTSLCTSBGAA
SCHEMBL13584226 0.88 MMP8 (0.56) CTSSCTSKCTSLCTSBGAA
SCHEMBL7140209 0.88 CASP1 (0.60) CTSSCTSKCTSLCTSBGAA
SCHEMBL992273 0.88 CTSS (0.50) CTSSCTSKCTSLCTSBGAA
SCHEMBL9068032 0.86 CTSS (0.57) CTSSCTSKCTSLCTSBTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130041180-A1 PROCESS FOR PREPARING (R)-2-ACETAMIDO-N-BENZYL-3-METHOXY-PROPIONAMIDE MSN LABORATORIES PRIVATE LIMITED (IN) 2013-02-14 US claimed
EP-2534127-A1 PROCESS FOR PREPARING (R)-2-ACETAMIDO-N-BENZYL-3-METHOXY-PROPIONAMIDE MSN Laboratories Limited (IN) 2012-12-19 EP claimed
WO-2011099033-A1 PROCESS FOR PREPARING (R)-2-ACETAMIDO-N-BENZYL-3-METHOXY-PROPIONAMIDE MSN LABORATORIES LIMITED (IN) 2011-08-18 WO claimed
US-20100240926-A1 PROCESS FOR PREPARING (R)-N-BENZYL-2-(BENYLOXYCARBONYLAMINO)-3-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 US claimed
EP-2444390-B1 Process for producing Lacosamide EUTICALS GMBH (DE) 2017-02-01 EP disclosed
EP-2444390-B1 Process for producing Lacosamide EUTICALS GMBH (DE) 2017-02-01 EP disclosed
US-20160031801-A1 DEUTERATED 2-AMINO-3-HYDROXYPROPANOIC ACID DERIVATIVES CONCERT PHARMACEUTICALS, INC. (US) 2016-02-04 US disclosed
US-20160031801-A1 DEUTERATED 2-AMINO-3-HYDROXYPROPANOIC ACID DERIVATIVES CONCERT PHARMACEUTICALS, INC. (US) 2016-02-04 US disclosed
US-9108902-B2 Deuterated 2-amino-3-hydroxypropanoic acid derivatives CONCERT PHARMACEUTICALS, INC. (US) 2015-08-18 US disclosed
US-9108902-B2 Deuterated 2-amino-3-hydroxypropanoic acid derivatives CONCERT PHARMACEUTICALS, INC. (US) 2015-08-18 US disclosed
US-8907132-B2 Process for preparing (R)-2-acetamido-N-benzyl-3-methoxy-propionamide MSN LABORATORIES PRIVATE LIMITED (IN) 2014-12-09 US disclosed
US-8907132-B2 Process for preparing (R)-2-acetamido-N-benzyl-3-methoxy-propionamide MSN LABORATORIES PRIVATE LIMITED (IN) 2014-12-09 US disclosed
WO-2010107993-A3 PROCESS FOR PREPARING (R)-7V-BENZYL-2- (BENYLOXYCARBONYLAMINO)-S-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-11-04 WO disclosed
WO-2010107993-A2 PROCESS FOR PREPARING (R)-7V-BENZYL-2- (BENYLOXYCARBONYLAMINO)-S-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 WO disclosed
WO-2010107993-A2 PROCESS FOR PREPARING (R)-7V-BENZYL-2- (BENYLOXYCARBONYLAMINO)-S-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 WO disclosed
WO-2010107993-A2 PROCESS FOR PREPARING (R)-7V-BENZYL-2- (BENYLOXYCARBONYLAMINO)-S-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 WO disclosed
US-20100240926-A1 PROCESS FOR PREPARING (R)-N-BENZYL-2-(BENYLOXYCARBONYLAMINO)-3-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 US disclosed
US-20100240926-A1 PROCESS FOR PREPARING (R)-N-BENZYL-2-(BENYLOXYCARBONYLAMINO)-3-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 US disclosed
US-20100240926-A1 PROCESS FOR PREPARING (R)-N-BENZYL-2-(BENYLOXYCARBONYLAMINO)-3-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 US disclosed
US-20100240926-A1 PROCESS FOR PREPARING (R)-N-BENZYL-2-(BENYLOXYCARBONYLAMINO)-3-METHOXYPROPIONAMIDE PLIVA HRVATSKA D.O.O. (HR) 2010-09-23 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 (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-20100240926-A1 PROCESS FOR PREPARING (R)-N-BENZYL-2-(BENYLOXYCARBONYLAMINO)-3-METHOXYPROPIONAMIDE NAAA, MME, CA2 CTSS 414/4885CTSK 1666/4885CTSL 795/4885
US-20160031801-A1 DEUTERATED 2-AMINO-3-HYDROXYPROPANOIC ACID DERIVATIVES GRIN3A, GRIK5, GRIN2A CTSS 4649/4885CTSK 4527/4885CTSL 4486/4885
US-20130041180-A1 PROCESS FOR PREPARING (R)-2-ACETAMIDO-N-BENZYL-3-METHOXY-PROPIONAMIDE AMY1A, PTMA, NAAA CTSS 2565/4885CTSK 3441/4885CTSL 2798/4885

“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.