SCHEMBL7766978

SCHEMBL7766978

CCCCC[Si@H]1CC[C@H](CCCC[C@H]2CC[C@H](c3ccc(OCC(F)(F)F)c(F)c3)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.34
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
TNK2 Q07912 1/20 0.31
CNR2 P34972 2/20 0.30
SSTR4 P31391 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
SCHEMBL7766976 1.00 KDM1A (0.34) KDM1ADRD2DRD3TNK2CNR2
SCHEMBL7766981 1.00 KDM1A (0.34) KDM1ADRD2DRD3TNK2CNR2
SCHEMBL7767782 0.91 KDM1A (0.43) KDM1A
SCHEMBL7767779 0.91 KDM1A (0.43) KDM1A
SCHEMBL7767784 0.91 KDM1A (0.43) KDM1A
SCHEMBL8417308 0.85 PDE2A (0.34) KDM1A
SCHEMBL8417305 0.85 PDE2A (0.34) KDM1A
SCHEMBL7769893 0.85 CACNA1G (0.37) DRD2DRD3
SCHEMBL7762536 0.85 KDM1A (0.37) KDM1ADRD2DRD3CNR2
SCHEMBL7769899 0.85 CACNA1G (0.37) DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727428-B1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHINETSU CHEMICAL CO (JP) 2001-06-06 EP disclosed
US-5665271-A Silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-09-09 US disclosed
EP-0727428-A1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-08-21 EP disclosed