SCHEMBL1695172

SCHEMBL1695172

COC(Cc1ccccc1)C(N)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.49
SLC1A2 P43004 2/20 0.49
SLC1A1 P43005 2/20 0.49
EPHX1 P07099 2/20 0.49
ALPI P09923 1/20 0.49
PKM P14618 1/20 0.49
PTGS1 P23219 1/20 0.49
XIAP P98170 1/20 0.49
SLC7A5 Q01650 1/20 0.49
LAP3 P28838 4/20 0.47
SRR Q9GZT4 2/20 0.45
SLC6A2 P23975 2/20 0.44
TAAR1 Q96RJ0 2/20 0.44
MAOA P21397 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
CYP2A6 P11509 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 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
SCHEMBL8578236 0.85 EPHX1 (0.50) SLC1A3SLC1A2SLC1A1EPHX1ALPI
SCHEMBL2316542 0.82 EPHX1 (0.47) SLC1A3SLC1A2SLC1A1EPHX1ALPI
SCHEMBL2320960 0.82 EPHX1 (0.47) SLC1A3SLC1A2SLC1A1EPHX1ALPI
Hydrochloric Acid SCHEMBL5754335 0.77 SRR (0.61) EPHX1ALPIPKMPTGS1XIAP
SCHEMBL4780746 0.77 SRR (0.61) EPHX1ALPIPKMPTGS1XIAP
SCHEMBL901287 0.77 CTRB1 (0.49)
SCHEMBL15671356 0.77 TRPM8 (0.50) EPHX1SRRSIGMAR1
SCHEMBL27858195 0.76 CYP1A2 (0.50) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL295838 0.75 ALPI (0.55) SLC1A3SLC1A2SLC1A1EPHX1ALPI
SCHEMBL17905254 0.75 MEN1 (0.46) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013072933-A2 PROCESS FOR PREPARATION OF 2-ACETAMIDO-N-BENZYL-3-METHOXYPROPIONAMIDE GLENMARK GENERICS LIMITED (IN) 2013-05-23 WO 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
EP-2914574-A2 NEW PROCESS Cambrex Karlskoga Ab (SE) 2015-09-09 EP disclosed
US-8946476-B2 Process for the preparation of amino acid derivatives UCB PHARMA GMBH (DE) 2015-02-03 US disclosed
WO-2014068333-A2 NEW PROCESS CAMBREX KARLSKOGA AB (SE) 2014-05-08 WO disclosed
WO-2013072933-A2 PROCESS FOR PREPARATION OF 2-ACETAMIDO-N-BENZYL-3-METHOXYPROPIONAMIDE GLENMARK GENERICS LIMITED (IN) 2013-05-23 WO disclosed
EP-2582833-A1 ENZYMATIC RESOLUTION OF RACEMIC (2R,S)-2-(ACETYLAMINO)-3-METHOXY-N-(PHENYLMETHYL)PROPANAMIDE Medichem, S.A. (ES) 2013-04-24 EP disclosed
EP-2352721-B1 NOVEL PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES UCB PHARMA GMBH (DE) 2013-03-27 EP disclosed
EP-2534127-A1 PROCESS FOR PREPARING (R)-2-ACETAMIDO-N-BENZYL-3-METHOXY-PROPIONAMIDE MSN Laboratories Limited (IN) 2012-12-19 EP disclosed
WO-2011158194-A1 ENZYMATIC RESOLUTION OF RACEMIC (2R,S)-2-(ACETYLAMINO)-3-METHOXY-N-(PHENYLMETHYL)PROPANAMIDE MEDICHEM, S.A. (ES) 2011-12-22 WO disclosed
US-20110263899-A1 Novel Process for the Preparation of Amino Acid Derivatives UCB PHARMA GMBH (DE) 2011-10-27 US disclosed
WO-2011099033-A1 PROCESS FOR PREPARING (R)-2-ACETAMIDO-N-BENZYL-3-METHOXY-PROPIONAMIDE MSN LABORATORIES LIMITED (IN) 2011-08-18 WO disclosed
EP-2352721-A1 NOVEL PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES UCB Pharma GmbH (DE) 2011-08-10 EP disclosed
WO-2010052011-A1 NOVEL PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES UCB PHARMA, S.A. (BE) 2010-05-14 WO disclosed
WO-2000000463-A1 ANTICONVULSANT ENANTIOMERIC AMINO ACID DERIVATIVES RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 2000-01-06 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 (1 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-20110263899-A1 Novel Process for the Preparation of Amino Acid Derivatives BCAT2, DNPEP, NPEPPS SLC1A3 17/4885SLC1A2 8/4885SLC1A1 28/4885

“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.