SCHEMBL3278567

SCHEMBL3278567

O=C(O)NCC1CNCC1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 9/20 0.43
GAA P10253 2/20 0.42
GLB1 P16278 2/20 0.42
PYGL P06737 1/20 0.42
GBA2 Q9HCG7 1/20 0.42
MAN1B1 Q9UKM7 1/20 0.40
FUCA1 P04066 2/20 0.37
GLA P06280 2/20 0.37

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
SCHEMBL3278572 1.00 GBA1 (0.43) GBA1GAAGLB1PYGLGBA2
SCHEMBL3279555 1.00 GBA1 (0.43) GBA1GAAGLB1PYGLGBA2
SCHEMBL3233892 1.00 GBA1 (0.43) GBA1GAAGLB1PYGLGBA2
SCHEMBL3279547 1.00 GBA1 (0.43) GBA1GAAGLB1PYGLGBA2
SCHEMBL20660346 0.85 SLC6A1 (0.39) GBA1GAAGLB1PYGLGBA2
SCHEMBL20660344 0.85 SLC6A1 (0.39) GBA1GAAGLB1PYGLGBA2
SCHEMBL3619899 0.85 SLC6A1 (0.39) GBA1GAAGLB1PYGLGBA2
SCHEMBL22389582 0.85 SLC6A1 (0.39) GBA1GAAGLB1PYGLGBA2
SCHEMBL22389581 0.85 SLC6A1 (0.39) GBA1GAAGLB1PYGLGBA2
SCHEMBL3619898 0.85 SLC6A1 (0.39) GBA1GAAGLB1PYGLGBA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691850-B2 Antibacterial agents GLAXO GROUP LIMITED (GB) 2010-04-06 US disclosed
EP-1796466-A4 ANTIBACTERIAL AGENTS GLAXO GROUP LTD (GB) 2009-09-02 EP disclosed
US-20070287701-A1 6-({[(1-{2-[6-(methyloxy)-1,5-naphthyridin-4-yl]ethyl}-3-pyrrolidinyl)methyl]amino}methyl)-2H-pyrido[3,2-b][1,4]thiazin-3(4H)-one; bacterial infections; antibiotic resistance; Staphylococcus aureus, Streptococcus pneumoniae and pyogenes, Enterococcus; Haemophilus influenzae, Moraxella catarrhalis, E-coli SMITHKLINE BEECHAM CORPORATION 2007-12-13 US disclosed
EP-1796466-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2007-06-20 EP disclosed
WO-2006002047-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2006-01-05 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-20070287701-A1 6-({[(1-{2-[6-(methyloxy)-1,5-naphthyridin-4-yl]ethyl}-3-pyrrolidinyl)methyl]amino}methyl)-2H-pyrido[3,2-b][1,4]thiazin-3(4H)-one; bacterial infections; antibiotic resistance; Staphylococcus aureus, Streptococcus pneumoniae and pyogenes, Enterococcus; Haemophilus influenzae, Moraxella catarrhalis, E-coli NPM1, TOP1, HMGB1 GBA1 4124/4885GAA 2995/4885GLB1 1936/4885

“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.