SCHEMBL7847148

SCHEMBL7847148

CC(C)(C)OC(=O)N1CCC(CCS(=O)(=O)c2ccc3c(c2)CNCCC3)CC1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.51
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL7847185 0.89 GPR119 (0.54) GPR119NPC1RAB9A
SCHEMBL7838209 0.83 GPR119 (0.55) GPR119NPC1RAB9A
SCHEMBL7847552 0.82 NPC1 (0.46) GPR119NPC1RAB9A
SCHEMBL7848598 0.81 GPR119 (0.49) GPR119NPC1RAB9A
SCHEMBL7848718 0.81 NPC1 (0.46) GPR119NPC1RAB9A
SCHEMBL7838734 0.81 GPR119 (0.54) GPR119
SCHEMBL7848490 0.79 GPR119 (0.47) GPR119NPC1RAB9A
SCHEMBL7855571 0.79 GPR119 (0.52) GPR119
SCHEMBL6011574 0.77 GPR119 (0.58) GPR119
SCHEMBL6011356 0.77 GPR119 (0.71) 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
EP-1122252-A1 NITROGENOUS FUSED HETEROCYCLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME Takeda Chemical Industries, Ltd. (JP) 2001-08-08 EP disclosed