SCHEMBL3044802

SCHEMBL3044802

NCC(=O)CC(N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 7/20 0.50
GRIK2 Q13002 4/20 0.50
GRM1 Q13255 2/20 0.50
GRM2 Q14416 2/20 0.50
SLC7A5 Q01650 1/20 0.48
PTGS1 P23219 1/20 0.46
SLC7A11 Q9UPY5 1/20 0.46
GGT1 P19440 4/20 0.44
SLC1A1 P43005 4/20 0.44
GSR P00390 2/20 0.44
GRIA4 P48058 4/20 0.43
GRIK3 Q13003 4/20 0.43
GRIK5 Q16478 4/20 0.43
SLC1A3 P43003 3/20 0.43
SLC1A2 P43004 3/20 0.43
GRIA2 P42262 3/20 0.42
GRIA1 P42261 2/20 0.42
GRM8 O00222 1/20 0.42
GRM6 O15303 1/20 0.42
GRIN2D O15399 1/20 0.42

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
SCHEMBL564563 1.00 GRIK1 (0.50) GRIK1GRIK2GRM1GRM2SLC7A5
SCHEMBL3145928 1.00 GRIK1 (0.50) GRIK1GRIK2GRM1GRM2SLC7A5
SCHEMBL2474141 0.83 SLC7A5 (0.54) GRIK1GRIK2GRM1GRM2SLC7A5
SCHEMBL29148903 0.83 SLC7A5 (0.54) GRIK1GRIK2GRM1GRM2SLC7A5
SCHEMBL10618897 0.81 PTGS1 (0.55) GRIK1GRIK2GRM1GRM2SLC7A5
SCHEMBL6832737 0.81 PTGS1 (0.55) GRIK1GRIK2GRM1GRM2SLC7A5
SCHEMBL5296510 0.80 GRIK1 (0.46) GRIK1GRIK2GRM1GRM2SLC7A5
SCHEMBL6831240 0.80 GRIK1 (0.46) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL7717425 0.79 GLRA1 (0.53) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL307008 0.79 GLRA1 (0.53) GRIK1GRIK2GRM1GRM2SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107903337-A A kind of chitosan derivatives with mucosa-adherent and Pept-1 targetings and preparation method thereof 中国药科大学 2018-04-13 CN claimed
US-7767826-B2 Process for the synthesis of L-(+)-ergothioneine PHARMATECH INTERNATIONAL, INC. (US) 2010-08-03 US claimed
US-20090093642-A1 PROCESS FOR THE SYNTHESIS OF L-(+)-ERGOTHIONEINE PHARMATECH INTERNATIONAL, INC. 2009-04-09 US claimed
WO-2009045413-A1 PROCESS FOR THE SYNTHESIS OF L-(+)-ERGOTHIONEINE PHARMATECH INTERNATIONAL, INC. (US) 2009-04-09 WO claimed
EP-0980366-B1 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2004-06-09 EP claimed
CN-107903337-A A kind of chitosan derivatives with mucosa-adherent and Pept-1 targetings and preparation method thereof 中国药科大学 2018-04-13 CN disclosed
US-9603943-B2 Polyesteramide platform for site specific drug delivery ABBOTT CARDIOVASCULAR SYSTEMS INC. (US) 2017-03-28 US disclosed
US-20150290336-A1 POLYESTERAMIDE PLATFORM FOR SITE SPECIFIC DRUG DELIVERY ABBOTT CARDIOVASCULAR SYSTEMS (US) 2015-10-15 US disclosed
US-9095619-B2 Polyesteramide platform for site specific drug delivery ABBOTT CARDIOVASCULAR SYSTEMS INC. (US) 2015-08-04 US disclosed
US-20150010491-A1 POLYESTERAMIDE PLATFORM FOR SITE SPECIFIC DRUG DELIVERY ABBOTT CARDIOVASCULAR SYSTEMS (US) 2015-01-08 US disclosed
US-8865148-B2 Polyesteramide platform for site specific drug delivery ABBOTT CARDIOVASCULAR SYSTEMS INC. (US) 2014-10-21 US disclosed
US-20140120053-A1 POLYESTERAMIDE PLATFORM FOR SITE SPECIFIC DRUG DELIVERY ABBOTT CARDIOVASCULAR SYSTEMS INC. (US) 2014-05-01 US disclosed
US-20090093642-A1 PROCESS FOR THE SYNTHESIS OF L-(+)-ERGOTHIONEINE PHARMATECH INTERNATIONAL, INC. 2009-04-09 US disclosed
WO-2009045413-A1 PROCESS FOR THE SYNTHESIS OF L-(+)-ERGOTHIONEINE PHARMATECH INTERNATIONAL, INC. (US) 2009-04-09 WO disclosed
EP-1952830-A1 Biologically absorbable coatings for implantable devices based on poly(ester amides) and methods for fabricating the same Abbott Cardiovascular Systems, Inc. (US) 2008-08-06 EP disclosed
EP-1694373-B1 BIOLOGICALLY ABSORBABLE COATINGS FOR IMPLANTABLE DEVICES BASED ON POLY(ESTER AMIDES) AND METHODS FOR FABRICATING THE SAME ABBOTT CARDIOVASCULAR SYSTEMS (US) 2007-11-21 EP disclosed
US-20070249801-A1 Biologically absorbable coatings for implantable devices based on poly(ester amides) and methods for fabricating the same ADVANCED CARDIOVASCULAR SYSTEMS, INC. 2007-10-25 US disclosed
US-20070243256-A1 Polyesteramide platform for site specific drug delivery ABBOTT CARDIOVASCULAR SYSTEMS INC. 2007-10-18 US disclosed
US-7220816-B2 Biologically absorbable coatings for implantable devices based on poly(ester amides) and methods for fabricating the same ADVANCED CARDIOVASCULAR SYSTEMS, INC. (US) 2007-05-22 US disclosed
US-20050131201-A1 Biologically absorbable coatings for implantable devices based on poly(ester amides) and methods for fabricating the same ADVANCED CARDIOVASCULAR SYSTEMS, INC. 2005-06-16 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-20070243256-A1 Polyesteramide platform for site specific drug delivery CES2, KIT, NAAA GRIK1 2902/4885GRIK2 2115/4885GRM1 4457/4885
US-20140120053-A1 POLYESTERAMIDE PLATFORM FOR SITE SPECIFIC DRUG DELIVERY CES2, KIT, NAAA GRIK1 2902/4885GRIK2 2115/4885GRM1 4457/4885
US-20150010491-A1 POLYESTERAMIDE PLATFORM FOR SITE SPECIFIC DRUG DELIVERY CES2, KIT, NAAA GRIK1 2902/4885GRIK2 2115/4885GRM1 4457/4885
US-20150290336-A1 POLYESTERAMIDE PLATFORM FOR SITE SPECIFIC DRUG DELIVERY CES2, KIT, NAAA GRIK1 2902/4885GRIK2 2115/4885GRM1 4457/4885
US-20090093642-A1 PROCESS FOR THE SYNTHESIS OF L-(+)-ERGOTHIONEINE TTPA, DTYMK, TST GRIK1 974/4885GRIK2 884/4885GRM1 3421/4885

“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.