SCHEMBL7757079

SCHEMBL7757079

O=C(Oc1ccc(C2CC[SiH](CCCCF)CC2)cc1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRG P62508 1/20 0.37
EPHX2 P34913 2/20 0.36
P2RY14 Q15391 1/20 0.36
FAAH O00519 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GCGR P47871 3/20 0.34
GIPR P48546 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HSD11B1 P28845 1/20 0.34
KDM2B Q8NHM5 1/20 0.34
DHODH Q02127 1/20 0.34
HTR2C P28335 2/20 0.33
MGLL Q99685 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL7757083 1.00 ESRRG (0.37) ESRRGEPHX2P2RY14FAAHHRH3
SCHEMBL7755760 1.00 ESRRG (0.37) ESRRGEPHX2P2RY14FAAHHRH3
SCHEMBL7755762 1.00 ESRRG (0.37) ESRRGEPHX2P2RY14FAAHHRH3
SCHEMBL7751072 0.87 KDM2B (0.41) EPHX2FAAHHRH3ALDH1A1MAPT
SCHEMBL7751078 0.87 KDM2B (0.41) EPHX2FAAHHRH3ALDH1A1MAPT
SCHEMBL7754663 0.87 KDM2B (0.41) EPHX2FAAHHRH3ALDH1A1MAPT
SCHEMBL7754667 0.87 KDM2B (0.41) EPHX2FAAHHRH3ALDH1A1MAPT
SCHEMBL8393100 0.85 L3MBTL1 (0.38) EPHX2P2RY14L3MBTL1
SCHEMBL8393103 0.85 L3MBTL1 (0.38) EPHX2P2RY14L3MBTL1
SCHEMBL8036253 0.82 KDM1A (0.34) EPHX2FAAHHRH3HTR2CL3MBTL1

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-0708107-B1 Novel silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition SHINETSU CHEMICAL CO (JP) 2001-02-28 EP disclosed
US-5624601-A Silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-04-29 US disclosed
EP-0708107-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