SCHEMBL1862334

SCHEMBL1862334

CS(=O)(=O)c1cccc(C(CC2CCCC2)C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 4/20 0.44
▸ ALDH1A1 P00352 4/20 0.42
▸ GAA P10253 2/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ KCNH2 Q12809 3/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CTSB P07858 1/20 0.38
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 1/20 0.38
▸ HSD11B1 P28845 1/20 0.38
▸ AKR1C3 P42330 2/20 0.37
▸ AKR1C2 P52895 2/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CTSD P07339 1/20 0.37
▸ BACE1 P56817 1/20 0.37
▸ BACE2 Q9Y5Z0 1/20 0.37
▸ VCP P55072 1/20 0.37
▸ CNR2 P34972 1/20 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
SCHEMBL1862330 1.00 GCK (0.44) GCKALDH1A1GAAMEN1KMT2A
SCHEMBL2646784 0.84 RXFP1 (0.40) GCKALDH1A1GAAMEN1KMT2A
SCHEMBL1865137 0.84 GCK (0.58) GCKMEN1KMT2AKCNH2
SCHEMBL1865136 0.84 GCK (0.58) GCKMEN1KMT2AKCNH2
SCHEMBL2646180 0.83 GCK (0.57) GCKMEN1KMT2AKCNH2
SCHEMBL2646260 0.83 GCK (0.57) GCKMEN1KMT2AKCNH2
SCHEMBL2647441 0.81 KCNH2 (0.50) GCKKCNH2
SCHEMBL1171354 0.79 KCNH2 (0.62) GCKMEN1KMT2AKCNH2
SCHEMBL1418773 0.79 CYP2C19 (0.47) —
SCHEMBL1418768 0.79 CYP2C19 (0.47) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935699-B2 Pyrazole glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2011-05-03 — — US disclosed
EP-2261216-A2 Pyrazoles as glucokinase activators F. Hoffmann-La Roche AG (CH) 2010-12-15 — — EP disclosed
CN-101541756-A Pyrazoles as glucokinase activators HOFFMANN LA ROCHE (CH) 2009-09-23 — — CN disclosed
EP-2046755-A2 PYRAZOLES AS GLUCOKINASE ACTIVATORS F. Hoffmann-Roche AG (CH) 2009-04-15 — — EP disclosed
WO-2008012227-A2 PYRAZOLES AS GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2008-01-31 — — WO disclosed
US-20080021032-A1 Pyrazole glucokinase activators BERTHEL STEVEN JOSEPH 2008-01-24 — — 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-20080021032-A1 Pyrazole glucokinase activators GCKR, GCK, GALK1 GCK 2/4885ALDH1A1 1567/4885GAA 150/4885

“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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