SCHEMBL1107663

SCHEMBL1107663

COC[C@H](C)Oc1cc(O[C@H]2CCOC2)cc(C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCK P35557 11/20 0.44
PDE4D Q08499 6/20 0.43
F2 P00734 3/20 0.41
F10 P00742 3/20 0.41
PRSS1 P07477 3/20 0.41
PRSS2 P07478 3/20 0.41
F7 P08709 3/20 0.41
F3 P13726 3/20 0.41
PRSS3 P35030 3/20 0.41
RARA P10276 1/20 0.41
RARB P10826 1/20 0.41
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
RARG P13631 1/20 0.39

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
SCHEMBL1107677 1.00 GCK (0.44) GCKPDE4DF2F10PRSS1
SCHEMBL9891688 0.91 PDE4D (0.43) GCKPDE4DF2F10PRSS1
SCHEMBL9891689 0.91 PDE4D (0.43) GCKPDE4DF2F10PRSS1
SCHEMBL1107678 0.90 PDE4D (0.43) GCKPDE4DF2F10PRSS1
SCHEMBL1107674 0.90 PDE4D (0.43) GCKPDE4DF2F10PRSS1
SCHEMBL1107734 0.80 GCK (0.57) GCKRARARARBRARG
SCHEMBL1107709 0.76 GCK (0.55) GCKRARARARBRARG
SCHEMBL1107706 0.76 GCK (0.63) GCKRARARARBRARG
SCHEMBL2668774 0.76 GCK (0.47) GCKF2PRSS1RARARARB
SCHEMBL1774561 0.73 MEN1 (0.63) GCKPDE4DF2F10PRSS1

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-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 US disclosed
US-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 US disclosed
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 US disclosed
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 US disclosed
WO-2008005964-A2 PHOSPHONATE AND PHOSPHINATE COMPOUNDS AS GLUCOKINASE ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 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-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 GCK 2/4885PDE4D 1988/4885F2 4018/4885

“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.