SCHEMBL7758042

SCHEMBL7758042

CCCCC[Si]1(c2ccccc2)CCC(CCC2C=CC(=O)CC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 4/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD2 P14416 1/20 0.30
CHRM3 P20309 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30

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
SCHEMBL7759523 0.83 CHRM2 (0.33) GRM2CHRM2CHRM4CHRM5CHRM1
SCHEMBL7752933 0.81
SCHEMBL7765247 0.77 KCNH2 (0.33)
SCHEMBL7765244 0.77 KCNH2 (0.33)
SCHEMBL7758795 0.75 TSHR (0.33) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL7758047 0.74
SCHEMBL7760259 0.74 KCNH2 (0.34)
SCHEMBL7759928 0.73 KCNH2 (0.32)
SCHEMBL7755593 0.73 KCNH2 (0.32) GRM2
SCHEMBL3373521 0.73 CYP1A2 (0.41) GRM2

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-0711777-B1 Cyclohexanone compounds, a process for preparing the cyclohexanone compounds, and a process for preparing silacyclohexane-based compounds from the cyclohexanone compounds SHINETSU CHEMICAL CO (JP) 2001-04-04 EP disclosed