SCHEMBL2645542

SCHEMBL2645542

CS(=O)(=O)c1ccc(C2[CH]CCC2)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 5/20 0.33
▸ SLC6A2 P23975 3/20 0.33
▸ SLC6A4 P31645 3/20 0.33
▸ SLC6A3 Q01959 3/20 0.33
▸ KCNH2 Q12809 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ADRA1D P25100 1/20 0.32
▸ ACHE P22303 1/20 0.31
▸ GSTO1 P78417 1/20 0.31
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ GRM4 Q14833 1/20 0.30

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
SCHEMBL2652927 0.86 L3MBTL1 (0.35) L3MBTL1
SCHEMBL2645256 0.82 TSHR (0.33) L3MBTL1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2645512 0.79 PIK3CD (0.34) L3MBTL1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL27466234 0.70 GCK (0.33) GCKSLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL1878862 0.68 HTR3A (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL1625796 0.66 CCR2 (0.51) —
SCHEMBL16879246 0.66 PDE4A (0.51) —
SCHEMBL12186139 0.64 L3MBTL1 (0.44) L3MBTL1ADRA1DPIK3CDPIK3CAPIK3CB
SCHEMBL2646455 0.64 L3MBTL1 (0.39) L3MBTL1ADRA1DPIK3CDPIK3CAPIK3CB
SCHEMBL27286780 0.64 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572670-B1 5-SUBSTITUTED-PYRAZINE OR -PYRIDINE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2007-08-22 — — EP disclosed
US-20020111372-A1 FUSED HETEROAROMATIC GLUCOKINASE ACTIVATORS CORBETT WENDY L (US) 2002-08-15 — — US disclosed
EP-1169312-A2 GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2002-01-09 — — EP disclosed
WO-2000058293-A2 GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2000-10-05 — — 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-20020111372-A1 FUSED HETEROAROMATIC GLUCOKINASE ACTIVATORS GCKR, GCK, GPR119 GCK 2/4885SLC6A2 3377/4885SLC6A4 3229/4885

“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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