SCHEMBL30567986

SCHEMBL30567986

CC(C)(C)OC(=O)N1CCC(=C(c2ccncc2)c2cccc(S(C)(=O)=O)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 13/20 0.51
▸ FNTA P49354 1/20 0.43
▸ FNTB P49356 1/20 0.43
▸ NR1H2 P55055 5/20 0.42
▸ NR1H3 Q13133 4/20 0.41
▸ STS P08842 1/20 0.41

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
SCHEMBL23211871 1.00 GPR119 (0.51) GPR119FNTAFNTBNR1H2NR1H3
SCHEMBL22491548 0.92 GPR119 (0.54) GPR119NR1H2NR1H3STS
SCHEMBL29734566 0.92 GPR119 (0.54) GPR119NR1H2NR1H3STS
SCHEMBL30149843 0.90 GPR119 (0.49) GPR119NR1H2NR1H3
SCHEMBL23212048 0.90 GPR119 (0.49) GPR119NR1H2NR1H3
SCHEMBL30568010 0.90 GPR119 (0.49) GPR119NR1H2NR1H3
SCHEMBL21381608 0.85 FNTA (0.50) FNTAFNTB
SCHEMBL22491507 0.82 GPR119 (0.53) GPR119
SCHEMBL22491440 0.78 LMNA (0.50) GPR119
SCHEMBL29734416 0.78 LMNA (0.50) 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
CN-111936503-B Oxazine monoacylglycerol lipase (MAGL) inhibitors 豪夫迈·罗氏有限公司 2023-09-12 — — CN disclosed
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