SCHEMBL7769966

SCHEMBL7769966

CCCCC[SiH]1CCC(C2CCC(CCCCc3ccc(C(F)=CF)c(F)c3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.37
RARA P10276 1/20 0.37
RARG P13631 1/20 0.37
ITGB3 P05106 1/20 0.33
ITGA2B P08514 1/20 0.33
PPARA Q07869 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C8 P10632 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
S1PR3 Q99500 1/20 0.32
KAT8 Q9H7Z6 2/20 0.31

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
SCHEMBL7769959 1.00 RARB (0.37) RARBRARARARGITGB3ITGA2B
SCHEMBL7769957 1.00 RARB (0.37) RARBRARARARGITGB3ITGA2B
SCHEMBL7769960 1.00 RARB (0.37) RARBRARARARGITGB3ITGA2B
SCHEMBL7767752 0.92 RARB (0.34) RARBRARARARGITGB3ITGA2B
SCHEMBL7767753 0.92 RARB (0.34) RARBRARARARGITGB3ITGA2B
SCHEMBL7767749 0.92 RARB (0.34) RARBRARARARGITGB3ITGA2B
SCHEMBL7767747 0.92 RARB (0.34) RARBRARARARGITGB3ITGA2B
SCHEMBL7767829 0.88 ITGB3 (0.31) ITGB3ITGA2B
SCHEMBL7767833 0.88 ITGB3 (0.31) ITGB3ITGA2B
SCHEMBL7767825 0.88 ITGB3 (0.31) ITGB3ITGA2B

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