SCHEMBL9013071

SCHEMBL9013071

CCC[Si@H]1CC[C@H](CCc2cc(F)c(-c3ccc(Cl)c(F)c3)c(F)c2)CC1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
FPR2 P25090 1/20 0.31
PROKR1 Q8TCW9 1/20 0.31
CYP11B1 P15538 3/20 0.30
CYP11B2 P19099 3/20 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
SCHEMBL9013069 1.00 PDE4A (0.31) PDE4APDE4BPDE4CFPR2PROKR1
SCHEMBL9012843 0.86 MAOB (0.34)
SCHEMBL9012845 0.86 MAOB (0.34)
SCHEMBL8021738 0.85 CYP11B1 (0.31) PDE4APDE4BPDE4CCYP11B1CYP11B2
SCHEMBL9008452 0.85 CYP11B1 (0.31) PDE4APDE4BPDE4CCYP11B1CYP11B2
SCHEMBL8021742 0.85 CYP11B1 (0.31) PDE4APDE4BPDE4CCYP11B1CYP11B2
SCHEMBL8021745 0.85 CYP11B1 (0.31) PDE4APDE4BPDE4CCYP11B1CYP11B2
SCHEMBL8453469 0.84 MAOB (0.39) PDE4APDE4BPDE4CFPR2PROKR1
SCHEMBL8453472 0.84 MAOB (0.39) PDE4APDE4BPDE4CFPR2PROKR1
SCHEMBL7771840 0.83 RARB (0.40) FPR2PROKR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523440-A Silacyclohexane compound, a method of preparaing it and a liquid crystal composition containing it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-06-04 US disclosed
EP-0668286-A1 A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it Shin-Etsu Chemical Co., Ltd. (JP) 1995-08-23 EP disclosed