SCHEMBL16281337

SCHEMBL16281337

Cc1ncccc1Oc1ncnc(OC2CC3C=C[C@@H](C2)N3S(=O)(=O)C2CC2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 20/20 1.00

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
SCHEMBL12275133 1.00 GPR119 (1.00) GPR119
SCHEMBL12275389 0.89 GPR119 (1.00) GPR119
SCHEMBL12275302 0.89 GPR119 (1.00) GPR119
SCHEMBL12275242 0.87 GPR119 (0.77) GPR119
SCHEMBL12276538 0.87 GPR119 (0.92) GPR119
SCHEMBL12275581 0.85 GPR119 (0.76) GPR119
SCHEMBL12274462 0.83 GPR119 (1.00) GPR119
SCHEMBL12274973 0.83 GPR119 (1.00) GPR119
SCHEMBL12275126 0.83 GPR119 (1.00) GPR119
SCHEMBL12275120 0.82 GPR119 (0.87) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8907095-B2 Bicyclic heterocycle derivatives and their use as modulators of the activity of GPR119 MERCK SHARP & DOHME CORP. (US) 2014-12-09 — — US disclosed
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