SCHEMBL7763803

SCHEMBL7763803

CCCCC[Si@H]1CC[C@H](COc2ccc(Cl)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
LTA4H P09960 4/20 0.40
SIGMAR1 Q99720 2/20 0.37
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
KCNH2 Q12809 1/20 0.36
AGER Q15109 1/20 0.36

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
SCHEMBL7763797 1.00 TDP1 (0.40) TDP1LTA4HSIGMAR1LMNAMEN1
SCHEMBL7763811 0.92 TDP1 (0.37) TDP1LTA4HSIGMAR1KCNH2AGER
SCHEMBL7763815 0.92 TDP1 (0.37) TDP1LTA4HSIGMAR1KCNH2AGER
SCHEMBL7763805 0.92 TDP1 (0.37) TDP1LTA4HSIGMAR1KCNH2AGER
SCHEMBL7760386 0.86 TDP1 (0.40) TDP1LTA4HSIGMAR1
SCHEMBL7760381 0.86 TDP1 (0.40) TDP1LTA4HSIGMAR1
SCHEMBL7760283 0.85 TDP1 (0.40) TDP1LMNAMEN1ALDH1A1KMT2A
SCHEMBL7760287 0.85 TDP1 (0.40) TDP1LMNAMEN1ALDH1A1KMT2A
SCHEMBL7760352 0.83 PARP10 (0.41) TDP1KCNH2
SCHEMBL7761350 0.83 KDM1A (0.40) TDP1

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-0714899-B1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHINETSU CHEMICAL CO (JP) 2001-04-18 EP disclosed
US-5641430-A Silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-06-24 US disclosed
EP-0714899-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) 1996-06-05 EP disclosed