SCHEMBL1700570

SCHEMBL1700570

C=CCOC(=O)NCSC[C@H](N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.37
ARG2 P78540 1/20 0.37
GRIK1 P39086 2/20 0.35
GRIK2 Q13002 2/20 0.35
DDAH1 O94760 1/20 0.35
CASP1 P29466 6/20 0.34
NOS2 P35228 3/20 0.34
NOS1 P29475 2/20 0.34
NOS3 P29474 1/20 0.34
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL1700571 1.00 ARG1 (0.37) ARG1ARG2GRIK1GRIK2DDAH1
SCHEMBL16447139 0.86 ARG1 (0.42) ARG1ARG2GRIK1GRIK2DDAH1
SCHEMBL17852295 0.86 ARG1 (0.42) ARG1ARG2GRIK1GRIK2DDAH1
SCHEMBL20178599 0.86 ARG1 (0.42) ARG1ARG2GRIK1GRIK2DDAH1
SCHEMBL19514769 0.81 MEN1 (0.39) CASP1MAPTCACNA1BAPBA1SMN1; SMN2
SCHEMBL17324271 0.80 GFPT1 (0.45) GRIK1GRIK2DDAH1CASP1MAPT
SCHEMBL25660591 0.80 GFPT1 (0.45) GRIK1GRIK2DDAH1CASP1MAPT
Hydrochloric Acid SCHEMBL31496724 0.78 GFPT1 (0.44) GRIK1GRIK2DDAH1CASP1MAPT
SCHEMBL17852438 0.77 ARG1 (0.42) ARG1ARG2GRIK1GRIK2DDAH1
SCHEMBL16448162 0.77 ARG1 (0.42) ARG1ARG2GRIK1GRIK2DDAH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566334-B1 CONTROLLED DRUG RELEASE FROM SOLID SUPPORTS PROLYNX LLC (US) 2018-04-18 EP disclosed
EP-2566335-B1 CONTROLLED RELEASE OF ACTIVE COMPOUNDS FROM MACROMOLECULAR CONJUGATES PROLYNX LLC (US) 2016-06-29 EP disclosed
US-8946405-B2 Controlled release from solid supports PROLYNX LLC (US) 2015-02-03 US disclosed
US-8754190-B2 Controlled release from macromolecular conjugates PROLYNX LLC (US) 2014-06-17 US disclosed
US-8703907-B2 Controlled drug release from dendrimers PROLYNX LLC (US) 2014-04-22 US disclosed
US-20130123461-A1 CONTROLLED DRUG RELEASE FROM DENDRIMERS PROLYNX LLC (US) 2013-05-16 US disclosed
US-20130123487-A1 CONTROLLED RELEASE FROM SOLID SUPPORTS PROLYNX LLC (US) 2013-05-16 US disclosed
US-20130116407-A1 CONTROLLED RELEASE FROM MACROMOLECULAR CONJUGATES PROLYNX LLC 2013-05-09 US disclosed
EP-2571496-A1 CONTROLLED DRUG RELEASE FROM DENDRIMERS Prolynx Llc (US) 2013-03-27 EP disclosed
EP-2566334-A1 CONTROLLED DRUG RELEASE FROM SOLID SUPPORTS Prolynx Llc (US) 2013-03-13 EP disclosed
EP-2566335-A1 CONTROLLED RELEASE FROM MACROMOLECULAR CONJUGATES Prolynx Llc (US) 2013-03-13 EP disclosed
WO-2011140376-A1 CONTROLLED DRUG RELEASE FROM DENDRIMERS PROLYNX LLC (US) 2011-11-10 WO disclosed
WO-2011140393-A1 CONTROLLED RELEASE FROM MACROMOLECULAR CONJUGATES PROLYNX LLC (US) 2011-11-10 WO disclosed
WO-2011140392-A1 CONTROLLED DRUG RELEASE FROM SOLID SUPPORTS PROLYNX LLC (US) 2011-11-10 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 (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-20130123487-A1 CONTROLLED RELEASE FROM SOLID SUPPORTS SLC43A1, ABCB1, NAPA ARG1 778/4885ARG2 1014/4885GRIK1 4629/4885
US-20130123461-A1 CONTROLLED DRUG RELEASE FROM DENDRIMERS SLC43A1, SLC47A1, SLC47A2 ARG1 1360/4885ARG2 756/4885GRIK1 724/4885
US-20130116407-A1 CONTROLLED RELEASE FROM MACROMOLECULAR CONJUGATES ABCB1, ABCB11, GUSB ARG1 3168/4885ARG2 3330/4885GRIK1 3156/4885

“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.