SCHEMBL8417308

SCHEMBL8417308

CCCCC[SiH]1CCC(CCC2CCC(c3ccc(OC(F)(F)F)c(F)c3)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 7/20 0.34
EPHX2 P34913 6/20 0.33
KDM1A O60341 2/20 0.31
CYP2C9 P11712 1/20 0.31
SLC7A5 Q01650 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL8417305 1.00 PDE2A (0.34) PDE2AEPHX2KDM1ACYP2C9SLC7A5
SCHEMBL8005232 0.92 CTSK (0.34) PDE2AEPHX2CYP2C9ALDH1A1LMNA
SCHEMBL8005234 0.92 CTSK (0.34) PDE2AEPHX2CYP2C9ALDH1A1LMNA
SCHEMBL8005238 0.92 CTSK (0.34) PDE2AEPHX2CYP2C9ALDH1A1LMNA
SCHEMBL9008499 0.92 CTSK (0.34) PDE2AEPHX2CYP2C9ALDH1A1LMNA
SCHEMBL8015318 0.91 EPHX2 (0.32) PDE2AEPHX2
SCHEMBL8015320 0.91 EPHX2 (0.32) PDE2AEPHX2
SCHEMBL9008525 0.91 EPHX2 (0.32) PDE2AEPHX2
SCHEMBL8015315 0.91 EPHX2 (0.32) PDE2AEPHX2
SCHEMBL7769939 0.91 EPHX2 (0.33) PDE2AEPHX2KDM1ACYP2C9ALDH1A1

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-0648773-B1 A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it SHINETSU CHEMICAL CO (JP) 1999-09-08 EP disclosed
US-5547606-A Silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-08-20 US disclosed
EP-0648773-A1 A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it Shin-Etsu Chemical Co., Ltd. (JP) 1995-04-19 EP disclosed