SCHEMBL7754663

SCHEMBL7754663

CCC[SiH]1CCC(c2ccc(OC(=O)c3ccc(OC(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
EPHX2 P34913 3/20 0.38
HRH3 Q9Y5N1 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP2C9 P11712 1/20 0.38
FAAH O00519 2/20 0.37
LMNA P02545 1/20 0.36
KDM1A O60341 1/20 0.36
RCOR1 Q9UKL0 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
PDE5A O76074 1/20 0.36
FASN P49327 1/20 0.36
SCN9A Q15858 1/20 0.35
GCGR P47871 1/20 0.35

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
SCHEMBL7751072 1.00 KDM2B (0.41) KDM2BHDAC3HDAC1HDAC2EPHX2
SCHEMBL7751078 1.00 KDM2B (0.41) KDM2BHDAC3HDAC1HDAC2EPHX2
SCHEMBL7754667 1.00 KDM2B (0.41) KDM2BHDAC3HDAC1HDAC2EPHX2
SCHEMBL7757066 0.89 KMT2A (0.40) ALDH1A1MAPTSMN1; SMN2CYP2C9LMNA
SCHEMBL7757062 0.89 KMT2A (0.40) ALDH1A1MAPTSMN1; SMN2CYP2C9LMNA
SCHEMBL7754704 0.87 MAPT (0.50) ALDH1A1MAPTSMN1; SMN2CYP2C9LMNA
SCHEMBL7754699 0.87 MAPT (0.50) ALDH1A1MAPTSMN1; SMN2CYP2C9LMNA
SCHEMBL7755760 0.87 ESRRG (0.37) KDM2BHDAC3HDAC1HDAC2EPHX2
SCHEMBL7757079 0.87 ESRRG (0.37) KDM2BHDAC3HDAC1HDAC2EPHX2
SCHEMBL7755762 0.87 ESRRG (0.37) KDM2BHDAC3HDAC1HDAC2EPHX2

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