SCHEMBL9424847

SCHEMBL9424847

CCCCC[C@H](COS(=O)(=O)c1ccc(C)cc1)OC1CCCCO1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 1/20 0.37
SLC12A2 P55011 1/20 0.34
SLC12A5 Q9H2X9 1/20 0.34
FKBP1A P62942 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 1/20 0.33
DRD3 P35462 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
NPC1 O15118 1/20 0.32
NPY1R P25929 1/20 0.32
NPY2R P49146 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL9424842 1.00 PLA2G2C (0.37) PLA2G2CSLC12A2SLC12A5FKBP1ADRD2
SCHEMBL9424685 1.00 PLA2G2C (0.37) PLA2G2CSLC12A2SLC12A5FKBP1ADRD2
SCHEMBL26837241 0.93 SLC12A2 (0.36) PLA2G2CSLC12A2SLC12A5DRD2DRD1
SCHEMBL18729643 0.89 SLC12A2 (0.39) SLC12A2SLC12A5CYP1A2CYP2D6
SCHEMBL8074534 0.89 SLC12A2 (0.33) SLC12A2SLC12A5FKBP1ACYP1A2CYP2D6
SCHEMBL21565962 0.88 SLC12A2 (0.37) SLC12A2SLC12A5CYP1A2CYP2D6
SCHEMBL9348801 0.88 PLA2G2C (0.35) PLA2G2CSLC12A2SLC12A5FKBP1ADRD2
SCHEMBL9348812 0.88 PLA2G2C (0.35) PLA2G2CSLC12A2SLC12A5FKBP1ADRD2
SCHEMBL23766543 0.87 SLC12A2 (0.35) PLA2G2CSLC12A2SLC12A5
SCHEMBL8074531 0.87 SLC12A2 (0.34) SLC12A2SLC12A5DRD2DRD1DRD4

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
US-5290477-A Fluoroalkyl phenoxy containing pyrimidine-type compound TAKASAGO INTERNATIONAL CORPORATION (JP) 1994-03-01 US disclosed