SCHEMBL1107610

SCHEMBL1107610

CC(C)Oc1cc(OC2CCN(C(=O)OC(C)(C)C)CC2)cc(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.51
PDE4D Q08499 3/20 0.46
PDE4A P27815 2/20 0.45
PDE4B Q07343 2/20 0.45
PDE4C Q08493 2/20 0.45
CHEK2 O96017 1/20 0.44
P2RX3 P56373 2/20 0.44
P2RX2 Q9UBL9 2/20 0.44
TOP2A P11388 1/20 0.44
USP30 Q70CQ3 1/20 0.44
HRH3 Q9Y5N1 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL1107637 0.94 USP30 (0.49) GPR119PDE4DPDE4BCHEK2P2RX3
SCHEMBL9891684 0.91 GPR119 (0.51) GPR119PDE4DPDE4APDE4BPDE4C
SCHEMBL1107619 0.89 GPR119 (0.49) GPR119PDE4DPDE4APDE4BPDE4C
SCHEMBL12594149 0.85 USP30 (0.47) GPR119PDE4DPDE4BCHEK2P2RX3
SCHEMBL22258415 0.84 GPR119 (0.53) GPR119PDE4DPDE4APDE4BPDE4C
SCHEMBL23465889 0.83 GPR119 (0.63) GPR119PDE4DPDE4APDE4BPDE4C
SCHEMBL1107528 0.83 USP30 (0.46) GPR119PDE4DPDE4APDE4BPDE4C
SCHEMBL30955036 0.81 GPR119 (0.56) GPR119PDE4DPDE4APDE4BPDE4C
SCHEMBL2969976 0.81 GPR119 (0.56) GPR119PDE4DPDE4APDE4BPDE4C
SCHEMBL3156353 0.81 GPR119 (0.49) GPR119PDE4DPDE4APDE4BPDE4C

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
EP-2059522-B1 PHOSPHONATE AND PHOSPHINATE COMPOUNDS AS GLUCOKINASE ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2014-01-08 EP disclosed
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
WO-2008005964-A2 PHOSPHONATE AND PHOSPHINATE COMPOUNDS AS GLUCOKINASE ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 WO disclosed
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 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-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 GPR119 18/4885PDE4D 1988/4885PDE4A 1802/4885

“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.