SCHEMBL1859992

SCHEMBL1859992

CCCS(=O)(=O)c1ccc([C@@H](CC2CCCC2)C(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCK P35557 11/20 0.44
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 3/20 0.37
CTDSP1 Q9GZU7 2/20 0.36

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
SCHEMBL2646156 1.00 GCK (0.44) GCKRAB9ANPC1KMT2APOLB
SCHEMBL2646150 0.93 GCK (0.43) GCKRAB9ANPC1POLBCTDSP1
SCHEMBL2647881 0.91 GCK (0.47) GCKKMT2A
SCHEMBL2655284 0.85 ALDH1A1 (0.44) GCKKMT2APOLB
SCHEMBL2656660 0.84 GCK (0.42) GCKKMT2A
SCHEMBL1865136 0.84 GCK (0.58) GCKKMT2A
SCHEMBL1865137 0.84 GCK (0.58) GCKKMT2A
SCHEMBL2647319 0.84 GCK (0.43) GCKKMT2APOLB
SCHEMBL2646180 0.83 GCK (0.57) GCKKMT2A
SCHEMBL2646260 0.83 GCK (0.57) GCKKMT2A

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 2/4885RAB9A 3108/4885NPC1 2373/4885

“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.