SCHEMBL3277938

SCHEMBL3277938

CC(C)(C)OC(=O)N1CC(C#N)C(O[Si](C)(C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NR1H2 P55055 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ RECQL P46063 1/20 0.38
▸ JAK2 O60674 6/20 0.37
▸ JAK1 P23458 6/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ CTSK P43235 1/20 0.35
▸ GPR119 Q8TDV5 1/20 0.34
▸ EGLN2 Q96KS0 1/20 0.34

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
SCHEMBL3273037 1.00 USP2 (0.42) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL23351742 1.00 USP2 (0.42) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL2930976 0.89 USP2 (0.40) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL2930634 0.89 USP2 (0.40) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL2937600 0.89 USP2 (0.40) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL2930633 0.89 USP2 (0.40) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL3450213 0.84 NR1H2 (0.43) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL4592245 0.84 NR1H2 (0.43) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL27265945 0.84 NR1H2 (0.43) USP2SMN1; SMN2NR1H2MEN1ALDH1A1
SCHEMBL3451520 0.82 NR1H2 (0.41) USP2SMN1; SMN2NR1H2MEN1ALDH1A1

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 2 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
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

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 USP2 4069/4885SMN1; SMN2 2301/4885NR1H2 3001/4885

“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.

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