SCHEMBL8027900

SCHEMBL8027900

CCCCCCC[Si]1(c2ccccc2)CCC(=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.35
PTGS2 P35354 3/20 0.35
MGLL Q99685 2/20 0.35
FAAH O00519 1/20 0.35
EPHX2 P34913 1/20 0.34
PKM P14618 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
MMP2 P08253 3/20 0.34
MMP9 P14780 3/20 0.34
MMP3 P08254 1/20 0.34
GRM2 Q14416 3/20 0.33
MMP8 P22894 2/20 0.33
MMP13 P45452 2/20 0.33
NAAA Q02083 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
SCHEMBL8034665 0.98 CES2 (0.33) PTGS1PTGS2MGLLFAAHEPHX2
SCHEMBL8021312 0.87 MEN1 (0.32) MGLL
SCHEMBL8732796 0.86 KCNH2 (0.34) EPHX2PKMMMP2MMP9MMP3
SCHEMBL8021470 0.84 GRM2 (0.33) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL7755593 0.84 KCNH2 (0.32) GRM2
SCHEMBL9017962 0.84 MEN1 (0.35) CES2CES1MMP2MMP9MMP3
SCHEMBL8452872 0.84 ALDH1A1 (0.34)
SCHEMBL8731527 0.83 MEN1 (0.30)
SCHEMBL7759523 0.82 CHRM2 (0.33) GRM2
SCHEMBL8455937 0.82 DNM1 (0.34) PTGS2EPHX2PKMCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0713878-B1 A method of manufacturing a trans silacyclohexane compound SHINETSU CHEMICAL CO (JP) 2000-02-16 EP disclosed
US-6004478-A LIQUID CRYSTAL SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-12-21 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-0742222-A2 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-11-13 EP disclosed
US-5560866-A Process for preparing silacyclohexane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-10-01 US disclosed
EP-0732335-A1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-09-18 EP disclosed
EP-0713878-A1 A method of manufacturing a trans silacyclohexane compound Shin-Etsu Chemical Co., Ltd. (JP) 1996-05-29 EP disclosed
EP-0688776-A2 Process for preparing silacyclo-hexane compounds Shin-Etsu Chemical Co., Ltd. (JP) 1995-12-27 EP disclosed