SCHEMBL7757589

SCHEMBL7757589

CCCCC[SiH]1CCC(c2ccc(-c3ccc(OC(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
KDM1A O60341 2/20 0.39
RCOR1 Q9UKL0 1/20 0.39
SCN9A Q15858 1/20 0.39
GSK3B P49841 1/20 0.35
P2RY14 Q15391 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
GRM2 Q14416 1/20 0.34
GRIN2B Q13224 1/20 0.34
HRH2 P25021 1/20 0.34
HRH1 P35367 1/20 0.34
MAOB P27338 1/20 0.34
KIF11 P52732 1/20 0.34
NISCH Q9Y2I1 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
FASN P49327 1/20 0.34
SPHK1 Q9NYA1 1/20 0.33

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
SCHEMBL7757593 1.00 L3MBTL1 (0.40) L3MBTL1KDM1ARCOR1SCN9AGSK3B
SCHEMBL8372074 0.95 KDM1A (0.40) L3MBTL1KDM1ARCOR1SCN9AHDAC3
SCHEMBL8372072 0.95 KDM1A (0.40) L3MBTL1KDM1ARCOR1SCN9AHDAC3
SCHEMBL7759550 0.92 L3MBTL1 (0.36) L3MBTL1KDM1ARCOR1SCN9AP2RY14
SCHEMBL7759555 0.92 L3MBTL1 (0.36) L3MBTL1KDM1ARCOR1SCN9AP2RY14
SCHEMBL7753121 0.89 KDM1A (0.38) L3MBTL1KDM1ARCOR1SCN9AHDAC3
SCHEMBL7753129 0.89 KDM1A (0.38) L3MBTL1KDM1ARCOR1SCN9AHDAC3
SCHEMBL7753125 0.89 KDM1A (0.38) L3MBTL1KDM1ARCOR1SCN9AHDAC3
SCHEMBL8401239 0.89 KDM1A (0.38) L3MBTL1KDM1ARCOR1SCN9AHDAC3
SCHEMBL8393103 0.89 L3MBTL1 (0.38) L3MBTL1KDM1ARCOR1P2RY14GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696591-B1 Process for preparing silacyclohexane-based liquid crystal compounds SHINETSU CHEMICAL CO (JP) 2001-03-14 EP disclosed
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-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-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
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-5514824-A Process for preparing silacyclohexane-base liquid crystal compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-05-07 US disclosed
EP-0696591-A1 Process for preparing silacyclohexane-based liquid crystal compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-02-14 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
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