SCHEMBL7753068

SCHEMBL7753068

CCC[Si@H]1CC[C@H](c2ccc(-c3ccc(OC(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.34
GRM2 Q14416 4/20 0.32
NAAA Q02083 2/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
KDM1A O60341 2/20 0.31
KCNH2 Q12809 3/20 0.31
GRIN2B Q13224 3/20 0.31
CYP17A1 P05093 1/20 0.30
MGLL Q99685 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
SCHEMBL7753064 1.00 FPR2 (0.34) FPR2GRM2NAAAPDE4APDE4B
SCHEMBL7755821 0.92 MGLL (0.34) FPR2GRM2NAAAPDE4APDE4B
SCHEMBL7755825 0.92 MGLL (0.34) FPR2GRM2NAAAPDE4APDE4B
SCHEMBL8393883 0.87
SCHEMBL8393882 0.87
SCHEMBL7757239 0.87 GRM2 (0.33) GRM2NAAA
SCHEMBL7757235 0.87 GRM2 (0.33) GRM2NAAA
SCHEMBL8454725 0.87 KDM1A (0.34) NAAAKDM1ACYP17A1
SCHEMBL8454722 0.87 KDM1A (0.34) NAAAKDM1ACYP17A1
SCHEMBL8014690 0.85 MGLL (0.31) FPR2PDE4BMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718387-B1 A liquid crystal composition and a liquid crystal display element which contains it SHINETSU CHEMICAL CO (JP) 2001-03-14 EP disclosed
US-5951913-A Liquid crystal compositions comprising silacyclohexane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-09-14 US disclosed
EP-0650969-B1 A Silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it SHINETSU CHEMICAL CO (JP) 1999-05-26 EP disclosed
US-5762826-A Liquid crystal composition and a liquid crystal display element which contains it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-06-09 US disclosed
US-5755995-A DISAZO DYES, TRISAZO DYES AND ANTHRAQUINONE DYES WITH LIQUID CRYSTAL POLYMERS SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-05-26 US disclosed
US-5730901-A Silacyclohexane compounds, preparation thereof liquid crystal compositions comprising the same, and liquid crystal devices comprising the composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-03-24 US disclosed
EP-0799878-A1 Liquid crystal compositions and liquid crystal display elements containing same Shin-Etsu Chemical Co., Ltd. (JP) 1997-10-08 EP disclosed
US-5659059-A Silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-08-19 US disclosed
EP-0718387-A1 A liquid crystal composition and a liquid crystal display element which contains it SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-06-26 EP disclosed
EP-0650969-A1 A Silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it Shin-Etsu Chemical Co., Ltd. (JP) 1995-05-03 EP disclosed