SCHEMBL17008795

SCHEMBL17008795

CC(C)(C)N1CCC(Oc2ccc(C#N)cc2F)CC1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPR6 P46095 19/20 0.47
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL227505 0.85 HRH3 (0.61) GPR6HRH3
SCHEMBL1560104 0.85 PDE4B (0.45) GPR6HRH3
SCHEMBL28291788 0.83 GPR6 (0.51) GPR6
SCHEMBL23686797 0.81 SLC6A9 (0.47) GPR6
SCHEMBL18855637 0.81 SLC6A9 (0.47) GPR6HRH3
SCHEMBL223791 0.80 GPR119 (0.64) GPR6
SCHEMBL13726479 0.80 FPR2 (0.51) GPR6
SCHEMBL17009599 0.80 GPR119 (0.43) GPR6HRH3
SCHEMBL227139 0.80 GPR6 (0.58) GPR6
SCHEMBL29826343 0.80 GPR6 (0.41) GPR6

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3105216-A1 PYRAZINES MODULATORS OF GPR6 Takeda Pharmaceutical Company Limited (JP) 2016-12-21 EP disclosed
EP-3105230-A1 PYRIDOPYRAZINES MODULATORS OF GPR6 Takeda Pharmaceutical Company Limited (JP) 2016-12-21 EP disclosed
WO-2015123533-A1 PYRAZINES MODULATORS OF GPR6 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-08-20 WO disclosed
WO-2015123505-A1 PYRIDOPYRAZINES MODULATORS OF GPR6 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-08-20 WO disclosed