SCHEMBL7757350

SCHEMBL7757350

CCC[Si@H]1CC[C@H]([C@H]2CC[C@H](COc3ccc(Cl)c(F)c3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.38
PARP10 Q53GL7 3/20 0.38
PARP15 Q460N3 2/20 0.38
ATF4 P18848 3/20 0.36
SCN9A Q15858 2/20 0.35
GSK3B P49841 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
PDE2A O00408 1/20 0.34
BACE1 P56817 1/20 0.33
BACE2 Q9Y5Z0 1/20 0.33

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
SCHEMBL7757347 1.00 TRPV4 (0.38) TRPV4PARP10PARP15ATF4SCN9A
SCHEMBL7757353 1.00 TRPV4 (0.38) TRPV4PARP10PARP15ATF4SCN9A
SCHEMBL7761412 0.90 PARP10 (0.40) TRPV4PARP10PARP15SCN9AFFAR4
SCHEMBL7761418 0.90 PARP10 (0.40) TRPV4PARP10PARP15SCN9AFFAR4
SCHEMBL7761415 0.90 PARP10 (0.40) TRPV4PARP10PARP15SCN9AFFAR4
SCHEMBL7761399 0.87 MCL1 (0.39) PARP10PARP15PDE2A
SCHEMBL7761404 0.87 MCL1 (0.39) PARP10PARP15PDE2A
SCHEMBL7761395 0.87 MCL1 (0.39) PARP10PARP15PDE2A
SCHEMBL7763800 0.84 PARP10 (0.41) TRPV4PARP10PARP15ATF4SCN9A
SCHEMBL7757246 0.84 PARP10 (0.34) PARP10PARP15SCN9APDE2ABACE1

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