SCHEMBL20375463

SCHEMBL20375463

COc1ncnc(OC2CCN(C(=O)OC(C)C)CC2)c1C

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.71
CYP2C9 P11712 3/20 0.61
KCNH2 Q12809 1/20 0.54

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
SCHEMBL13107758 0.95 GPR119 (0.74) GPR119CYP2C9
SCHEMBL12259511 0.91 GPR119 (0.69) GPR119CYP2C9
SCHEMBL12236456 0.91 GPR119 (0.69) GPR119CYP2C9
SCHEMBL12258980 0.89 GPR119 (0.68) GPR119CYP2C9
SCHEMBL12236457 0.88 GPR119 (0.67) GPR119CYP2C9
SCHEMBL12236446 0.88 GPR119 (0.67) GPR119CYP2C9
SCHEMBL20375633 0.88 GPR119 (0.67) GPR119CYP2C9
SCHEMBL12236445 0.87 GPR119 (0.66) GPR119CYP2C9
SCHEMBL15712127 0.87 GPR119 (0.66) GPR119CYP2C9
SCHEMBL12236381 0.87 GPR119 (0.68) GPR119CYP2C9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382204-B1 PYRIMIDINE DERIVATIVES AS GPCR MODULATORS FOR USE IN THE TREATMENT OF OBESITY AND DIABETES MERCK SHARP & DOHME (US) 2018-07-11 EP disclosed