SCHEMBL30915775

SCHEMBL30915775

CC(C)(C)OC(=O)N1CC[C@@H]2CCC[C@H]21

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.46
▸ NR1H3 Q13133 1/20 0.46
▸ GPR119 Q8TDV5 4/20 0.43
▸ DPP7 Q9UHL4 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ HPGD P15428 1/20 0.42
▸ OPRK1 P41145 1/20 0.41
▸ PREP P48147 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
SCHEMBL18477510 1.00 NR1H2 (0.46) NR1H2NR1H3GPR119DPP7NPC1
SCHEMBL30915772 1.00 NR1H2 (0.46) NR1H2NR1H3GPR119DPP7NPC1
SCHEMBL20054395 0.97 NR1H2 (0.49) NR1H2NR1H3GPR119NPC1HSD17B10
SCHEMBL5755507 0.97 NR1H2 (0.49) NR1H2NR1H3GPR119NPC1HSD17B10
SCHEMBL19564479 0.97 NR1H2 (0.49) NR1H2NR1H3GPR119NPC1HSD17B10
SCHEMBL31726992 0.83 HSD17B10 (0.53) GPR119NPC1HSD17B10HPGD
SCHEMBL31664994 0.83 DPP4 (0.53) NR1H2GPR119HSD17B10PREP
SCHEMBL4292802 0.83 DPP4 (0.53) NR1H2GPR119HSD17B10PREP
SCHEMBL17948013 0.83 DPP4 (0.53) NR1H2GPR119HSD17B10PREP
SCHEMBL17226184 0.83 DPP4 (0.53) NR1H2GPR119HSD17B10PREP

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-118076599-A Dioxazines and their use in the treatment of GBA related diseases 泽拉丹麦有限公司 2024-05-24 — — CN disclosed
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