SCHEMBL8021470

SCHEMBL8021470

CCCCC[Si]1(c2ccc(C)cc2)CCC(=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGS1 P23219 3/20 0.32
PTGS2 P35354 3/20 0.32
MGLL Q99685 3/20 0.32
HTT P42858 1/20 0.32
FAAH O00519 1/20 0.32
MCHR1 Q99705 1/20 0.31
KCNH2 Q12809 1/20 0.30
RGS4 P49798 1/20 0.30
RGS8 P57771 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
SCHEMBL8031104 0.89 MGLL (0.32) MGLL
SCHEMBL8034665 0.86 CES2 (0.33) GRM2PTGS1PTGS2MGLLFAAH
SCHEMBL8027900 0.84 PTGS1 (0.35) GRM2PTGS1PTGS2MGLLFAAH
SCHEMBL8021126 0.83 HRH3 (0.38) GRM2L3MBTL1HTTMCHR1KCNH2
SCHEMBL8032803 0.82 MGLL (0.34) MGLL
SCHEMBL8021312 0.73 MEN1 (0.32) MGLL
SCHEMBL9017962 0.73 MEN1 (0.35)
SCHEMBL7755593 0.73 KCNH2 (0.32) GRM2KCNH2
SCHEMBL8732796 0.72 KCNH2 (0.34) GRM2HTTKCNH2
SCHEMBL7759523 0.71 CHRM2 (0.33) GRM2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673942-B1 Silacyclohexanone compounds as intermediates for the preparation of silacyclohexane-type liquid cristal compounds SHINETSU CHEMICAL CO (JP) 2000-11-08 EP disclosed
EP-0682031-B1 Silacyclohexane-based carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde compound SHINETSU CHEMICAL CO (JP) 2000-03-22 EP disclosed
US-5641431-A Silacyclohexanone compound and a method of preparing a silacyclohexane-type liquid crystal composition containing it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-06-24 US disclosed
US-5527490-A Silacyclohexane carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-06-18 US disclosed
EP-0682031-A1 Silacyclohexane carbaldehyde compounds and processes for preparing silycyclohexane-based liquid crystal compounds from the carbaldehyde compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 1995-11-15 EP disclosed
EP-0673942-A1 Silacyclohexanone compounds as intermediates for the preparation of silacyclohexane-type liquid cristal compounds Shin-Etsu Chemical Co., Ltd. (JP) 1995-09-27 EP disclosed