SCHEMBL7063383

SCHEMBL7063383

C[C@@H]1C[C@@H](CO)N(C(=O)OC(C)(C)C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.43
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
KLK7 P49862 1/20 0.33
TPSAB1 Q15661 1/20 0.32
TPSD1 Q9BZJ3 1/20 0.32
TPSG1 Q9NRR2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
PTPN2 P17706 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
SRC P12931 4/20 0.32
CTSK P43235 1/20 0.32

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
SCHEMBL7063384 1.00 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3KLK7
SCHEMBL12531098 1.00 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3KLK7
SCHEMBL6491278 0.82 NR1H2 (0.41) NR1H2CHRM2CHRM1CHRM3KLK7
SCHEMBL842624 0.81 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3KLK7
SCHEMBL13864152 0.81 CHRM2 (0.40) NR1H2CHRM2CHRM1CHRM3KLK7
SCHEMBL29997836 0.80 KLK7 (0.50) NR1H2KLK7
SCHEMBL13613731 0.80 TOP2A (0.34) NR1H2CHRM2CHRM1CHRM3
SCHEMBL13613732 0.80 TOP2A (0.34) NR1H2CHRM2CHRM1CHRM3
SCHEMBL17169858 0.80 KLK7 (0.50) NR1H2KLK7
SCHEMBL26045071 0.80 TOP2A (0.34) NR1H2CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1314041-A2 SCREEN FOR GLUTAMATE REUPTAKE INHIBITORS, STIMULATORS, AND MODULATORS Annovis, Inc. (US) 2003-05-28 EP disclosed
US-20020115688-A1 Screen for glutamate reuptake inhibitors, stimulators, and modulators ANNOVIS, INC. 2002-08-22 US disclosed
WO-2002018941-A2 SCREEN FOR GLUTAMATE REUPTAKE INHIBITORS, STIMULATORS, AND MODULATORS ANNOVIS, INC. (US) 2002-03-07 WO disclosed
EP-0809624-B1 ALKYLCARBOXY AMINO ACIDS-MODULATORS OF THE KAINATE RECEPTOR BEARSDEN BIO INC (US) 2001-08-29 EP disclosed
US-5731348-A NERVOUS SYSTEM DISORDERS BEARSDEN BIO, INC. (US) 1998-03-24 US disclosed
EP-0809624-A1 ALKYLCARBOXY AMINO ACIDS-MODULATORS OF THE KAINATE RECEPTOR Bearsden Bio, Inc. (US) 1997-12-03 EP disclosed
WO-1996025387-A1 ALKYLCARBOXY AMINO ACIDS-MODULATORS OF THE KAINATE RECEPTOR SYMPHONY PHARMACEUTICALS, INC. (US) 1996-08-22 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-20020115688-A1 Screen for glutamate reuptake inhibitors, stimulators, and modulators SLC18A2, SLC1A2, SLC1A1 NR1H2 1080/4885CHRM2 449/4885CHRM1 389/4885

“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.