SCHEMBL1864201

SCHEMBL1864201

CS(=O)(=O)c1ccc([C@@H](CC2CC(=O)C2)C(=O)O)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 6/20 0.55
KCNH2 Q12809 3/20 0.49
APP P05067 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
PTGDR Q13258 3/20 0.33
TBXA2R P21731 2/20 0.33
TRPV4 Q9HBA0 1/20 0.33
CHRM1 P11229 1/20 0.33
PTGS1 P23219 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL1864199 1.00 GCK (0.55) GCKKCNH2APPPSEN1PSEN2
SCHEMBL1860360 0.91 GCK (0.66) GCKKCNH2APPPSEN1PSEN2
SCHEMBL21820635 0.91 GCK (0.66) GCKKCNH2APPPSEN1PSEN2
SCHEMBL1862618 0.91 GCK (0.66) GCKKCNH2APPPSEN1PSEN2
SCHEMBL2642209 0.91 GCK (0.66) GCKKCNH2APPPSEN1PSEN2
SCHEMBL1860363 0.91 GCK (0.66) GCKKCNH2APPPSEN1PSEN2
SCHEMBL1862621 0.91 GCK (0.66) GCKKCNH2APPPSEN1PSEN2
SCHEMBL1858970 0.91 GCK (0.55) GCKKCNH2PTGDRTBXA2RTRPV4
SCHEMBL1858972 0.91 GCK (0.55) GCKKCNH2PTGDRTBXA2RTRPV4
SCHEMBL2642110 0.88 GCK (0.58) GCKKCNH2APPPSEN1PSEN2

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-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
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 2/4885KCNH2 2241/4885APP 3732/4885

“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.