SCHEMBL8079201

SCHEMBL8079201

O=C(O)C1CC[Si](CCCCF)(c2ccccc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.35
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
AKR1C3 P42330 1/20 0.33
AKR1C1 Q04828 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
OPRM1 P35372 1/20 0.32
NOTUM Q6P988 3/20 0.32
PLG P00747 1/20 0.31
PLAT P00750 1/20 0.31
LMNA P02545 1/20 0.31
VCP P55072 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
TAS2R14 Q9NYV8 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
SCHEMBL8073707 0.84 KCNH2 (0.41)
SCHEMBL8073971 0.81 KDM4E (0.36) POLBL3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL8074187 0.81 POLB (0.34) POLBL3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL8077099 0.81 POLB (0.35) POLBL3MBTL1RAB9ANPC1AKR1C3
SCHEMBL7756908 0.79 ESRRG (0.35) RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL7760261 0.78
SCHEMBL8451929 0.78
SCHEMBL8073314 0.77 PPARG (0.37) POLBL3MBTL1RAB9ANPC1AKR1C3
SCHEMBL8920660 0.77 NPC1 (0.35) POLBL3MBTL1RAB9ANPC1AKR1C3
SCHEMBL8731527 0.76 MEN1 (0.30)

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-0708106-B1 Novel silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition SHINETSU CHEMICAL CO (JP) 2000-08-09 EP disclosed
US-5650092-A LIQUID CRYSTAL COMPOUNDS FOR DEVICES WITH ESTER COMPOUNDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-07-22 US disclosed
EP-0708106-A1 Novel silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-04-24 EP disclosed