SCHEMBL7762574

SCHEMBL7762574

CCCCC[SiH]1CCC([C@H]2CC[C@H](CCCCc3ccc(OC(F)(F)F)cc3)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.35
TSHR P16473 1/20 0.34
ITGB3 P05106 2/20 0.34
ITGA2B P08514 2/20 0.34
SLC6A4 P31645 4/20 0.34
SLC6A3 Q01959 4/20 0.34
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
EPHX2 P34913 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
DAO P14920 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
ALDH1A1 P00352 1/20 0.32
THRB P10828 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM3 P20309 1/20 0.32
LIPE Q05469 1/20 0.32
HDAC3 O15379 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
SCHEMBL7762581 1.00 FAAH (0.35) FAAHTSHRITGB3ITGA2BSLC6A4
SCHEMBL7762577 1.00 FAAH (0.35) FAAHTSHRITGB3ITGA2BSLC6A4
SCHEMBL8015344 0.94 TSHR (0.36) TSHRSLC6A4SLC6A3ALOX5PPARG
SCHEMBL7769722 0.94 TSHR (0.36) FAAHTSHRSLC6A4SLC6A3ALOX5
SCHEMBL8015343 0.94 TSHR (0.36) TSHRSLC6A4SLC6A3ALOX5PPARG
SCHEMBL7769719 0.94 TSHR (0.36) FAAHTSHRSLC6A4SLC6A3ALOX5
SCHEMBL8015349 0.94 TSHR (0.36) TSHRSLC6A4SLC6A3ALOX5PPARG
SCHEMBL7769727 0.94 TSHR (0.36) FAAHTSHRSLC6A4SLC6A3ALOX5
SCHEMBL9398410 0.90 FAAH (0.42) FAAHTSHRITGB3ITGA2BSLC6A4
SCHEMBL9191161 0.90 FAAH (0.42) FAAHTSHRITGB3ITGA2BSLC6A4

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