SCHEMBL8073971

SCHEMBL8073971

COCCCCC[Si]1(c2ccccc2)CCC(C(=O)O)CC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
LMNA P02545 1/20 0.36
S1PR5 Q9H228 1/20 0.36
KMT2A Q03164 2/20 0.34
GAA P10253 2/20 0.34
PDE4B Q07343 1/20 0.34
ALDH1A1 P00352 2/20 0.34
POLB P06746 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
PPARG P37231 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HPGD P15428 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 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
SCHEMBL8916577 0.93 KDM4E (0.33) KDM4ELMNAS1PR5KMT2AGAA
SCHEMBL8073707 0.85 KCNH2 (0.41) S1PR5PPARG
SCHEMBL8079201 0.81 POLB (0.37) LMNAGAAALDH1A1POLBSMN1; SMN2
SCHEMBL8454689 0.81 ALDH1A1 (0.33) KMT2AALDH1A1MEN1
SCHEMBL7755500 0.79 ESR2 (0.36)
SCHEMBL8452872 0.79 ALDH1A1 (0.34) KDM4ELMNAKMT2AALDH1A1POLB
SCHEMBL7758031 0.79 KDM4E (0.32) KDM4ELMNAGAAL3MBTL1MAPK1
SCHEMBL7759947 0.77 RAB9A (0.34) KDM4EALDH1A1POLBRAB9A
SCHEMBL8077099 0.76 POLB (0.35) LMNAKMT2AGAAALDH1A1POLB
SCHEMBL8920660 0.75 NPC1 (0.35) S1PR5KMT2AGAAALDH1A1POLB

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