SCHEMBL26144164

SCHEMBL26144164

Fc1ccc(OC2CCCCC2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.41
GPR6 P46095 10/20 0.41
PDE4D Q08499 1/20 0.41
CYP2D6 P10635 4/20 0.41
GRIN1 Q05586 2/20 0.40
GRIN2B Q13224 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
PDE4A P27815 1/20 0.40
MCHR1 Q99705 1/20 0.40

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
SCHEMBL29555 0.90 GRIN1 (0.43) GPR6CYP2D6GRIN1GRIN2B
SCHEMBL13419191 0.82 SYK (0.47) CSNK2A1PDE4DGRIN1GRIN2BPTGDR2
SCHEMBL3115490 0.82 GPR6 (0.41) GPR6CYP2D6GRIN1GRIN2B
SCHEMBL622131 0.82 CSNK2A1 (0.43) CSNK2A1PDE4DPDE4AMCHR1
SCHEMBL941030 0.82 SLC6A2 (0.58)
SCHEMBL24439649 0.82 NPY1R (0.49) CSNK2A1PDE4DPTGDR2PDE4A
SCHEMBL9538522 0.81 SLC6A2 (0.56) PDE4DPDE4AMCHR1
Hydrochloric Acid SCHEMBL2778482 0.81 SLC6A2 (0.56)
SCHEMBL22114120 0.80 SYK (0.48) CSNK2A1GPR6PDE4DGRIN1GRIN2B
SCHEMBL5880750 0.80 NPY1R (0.50) CSNK2A1PDE4DPDE4A

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-3600312-B1 PIPERIDINYL- AND PIPERAZINYL-SUBSTITUTED HETEROAROMATIC CARBOXAMIDES AS MODULATORS OF GPR6 TAKEDA PHARMACEUTICALS CO (JP) 2023-05-17 EP disclosed