SCHEMBL9008446

SCHEMBL9008446

CCC[SiH]1CCC(CC[C@H]2CC[C@H](c3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
KDM1A O60341 2/20 0.38
RCOR1 Q9UKL0 1/20 0.38
CYP2C9 P11712 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
MAOB P27338 1/20 0.33
GRM2 Q14416 1/20 0.33
GPR88 Q9GZN0 1/20 0.33
MMP12 P39900 1/20 0.33
FASN P49327 1/20 0.33
KIF11 P52732 1/20 0.33
ESR2 Q92731 1/20 0.33
P2RY14 Q15391 1/20 0.33
EPHX2 P34913 1/20 0.32
CHRM2 P08172 1/20 0.32

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
SCHEMBL8017671 1.00 L3MBTL1 (0.38) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL8017666 1.00 L3MBTL1 (0.38) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL8017669 1.00 L3MBTL1 (0.38) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL8415929 0.96 KDM1A (0.40) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL7759939 0.96 KDM1A (0.40) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL8415932 0.96 KDM1A (0.40) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL7759942 0.96 KDM1A (0.40) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL7759555 0.92 L3MBTL1 (0.36) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL7759550 0.92 L3MBTL1 (0.36) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1
SCHEMBL7762601 0.92 KDM1A (0.38) L3MBTL1KDM1ARCOR1CYP2C9ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5582764-A Silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-12-10 US disclosed