SCHEMBL4561845

SCHEMBL4561845

CC(OC(=O)N1CCC(N(C)Cc2cnc(-c3ccc(S(C)(=O)=O)cc3)cn2)CC1)C1CC1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.50
RORC P51449 1/20 0.43

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
SCHEMBL4048482 0.95 GPR119 (0.56) GPR119RORC
SCHEMBL3982569 0.90 GPR119 (0.48) GPR119
SCHEMBL4057316 0.88 GPR119 (0.58) GPR119RORC
SCHEMBL4053567 0.88 GPR119 (0.47) GPR119RORC
SCHEMBL4060086 0.85 RORC (0.46) GPR119RORC
SCHEMBL4056917 0.84 NPY2R (0.48) GPR119RORC
SCHEMBL4049314 0.84 GPR119 (0.49) GPR119RORC
SCHEMBL3980850 0.84 GPR119 (0.53) GPR119
SCHEMBL4048254 0.84 GPR119 (0.46) GPR119
SCHEMBL4058099 0.83 RORC (0.47) GPR119RORC

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
WO-2009106561-A1 PYRAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed