SCHEMBL349825

SCHEMBL349825

NCC(=O)C(N)(CN)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 1/20 0.38
SLC6A9 P48067 1/20 0.38
OR51E2 Q9H255 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
ARG1 P05089 1/20 0.32
ARG2 P78540 1/20 0.32
ODC1 P11926 2/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL7205332 0.86 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL825611 0.83 SMN1; SMN2 (0.42) GLRA1SLC6A9OR51E2SMN1; SMN2HIF1A
SCHEMBL8601948 0.80 SMN1; SMN2 (0.34) SMN1; SMN2HIF1AARG1ARG2ODC1
SCHEMBL2007928 0.80 SMN1; SMN2 (0.39) SMN1; SMN2HIF1AARG1ARG2ODC1
SCHEMBL4361740 0.80 MEN1 (0.39) GLRA1SLC6A9OR51E2SMN1; SMN2HIF1A
SCHEMBL619053 0.80 TSHR (0.35) SMN1; SMN2HIF1AARG1ARG2
SCHEMBL9324958 0.78 SMN1; SMN2 (0.33) GLRA1SLC6A9OR51E2SMN1; SMN2HIF1A
SCHEMBL439437 0.78 SMN1; SMN2 (0.33) GLRA1SLC6A9OR51E2SMN1; SMN2HIF1A
SCHEMBL11211091 0.77 THRB (0.45) GLRA1SLC6A9OR51E2SMN1; SMN2HIF1A
SCHEMBL8991294 0.77 SMN1; SMN2 (0.32) SMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778871-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-07-15 US disclosed
EP-1577323-B1 METASTIN DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2013-07-10 EP disclosed
US-8361968-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-01-29 US disclosed
US-20120015868-A1 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-19 US disclosed
US-20090318365-A1 METASTIN DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-24 US disclosed
US-20090298765-A1 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-03 US disclosed
US-7625869-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-01 US disclosed
EP-2113513-A2 Metastin derivatives and use thereof Takeda Pharmaceutical Company Limited (JP) 2009-11-04 EP disclosed
US-20080312155-A1 Metastin Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-18 US disclosed
EP-1758932-A2 METASTIN DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-03-07 EP disclosed
US-20060241051-A1 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-26 US disclosed
WO-2006001499-A2 METASTIN DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-05 WO disclosed
EP-1577323-A1 METASTIN DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-09-21 EP 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-20120015868-A1 Metastin derivatives and use thereof MET, HGFAC, HGF GLRA1 4642/4885SLC6A9 3815/4885OR51E2 3431/4885
US-20090318365-A1 METASTIN DERIVATIVES AND USE THEREOF MET, HGF, HGFAC GLRA1 4666/4885SLC6A9 3768/4885OR51E2 3499/4885
US-20080312155-A1 Metastin Derivatives and Use Thereof GNRHR, SHBG, MEN1 GLRA1 4303/4885SLC6A9 3468/4885OR51E2 3067/4885
US-20060241051-A1 Metastin derivatives and use thereof MET, HGFAC, HGF GLRA1 4642/4885SLC6A9 3815/4885OR51E2 3431/4885
US-20090298765-A1 Metastin derivatives and use thereof GNRHR, SHBG, MEN1 GLRA1 4303/4885SLC6A9 3468/4885OR51E2 3067/4885

“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.