SCHEMBL2246142

SCHEMBL2246142

CCc1cnc(N2CCC(CCCOc3ccc(CO)c(CCO)n3)CC2)nc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.41
KCNH2 Q12809 2/20 0.36
CYP11B2 P19099 1/20 0.36
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
FFAR4 Q5NUL3 2/20 0.33
PDE8B O95263 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 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
SCHEMBL2250812 0.83 GPR119 (0.45) GPR119KCNH2PPARGPPARDPPARA
SCHEMBL2253644 0.78 GPR119 (0.42) GPR119KCNH2PPARGPPARDPPARA
SCHEMBL1922288 0.77 GPR119 (0.51) GPR119CYP11B2PDE8BPIK3CAMTOR
SCHEMBL1296300 0.76 GPR119 (0.43) GPR119KCNH2PPARGPPARDPPARA
SCHEMBL1296033 0.76 GPR119 (0.43) GPR119KCNH2FFAR4PDE8B
SCHEMBL19438238 0.74 GPR119 (0.47) GPR119CYP11B2PDE8BPIK3CAMTOR
SCHEMBL2247748 0.73 GPR119 (0.46) GPR119KCNH2PDE8B
SCHEMBL1924194 0.72 GPR119 (0.54) GPR119
SCHEMBL12356451 0.72 GPR119 (0.53) GPR119PDE8B
SCHEMBL1295698 0.71 GPR119 (0.39) GPR119

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-20110190263-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-08-04 US disclosed
US-20110190263-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-08-04 US disclosed
US-20110190263-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-08-04 US disclosed
EP-2252613-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM, LLC (BM) 2010-11-24 EP disclosed
WO-2009105717-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-08-27 WO disclosed
WO-2009105717-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-08-27 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-20110190263-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GPR65, GPR39 GPR119 1/4885KCNH2 1627/4885CYP11B2 676/4885

“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.