SCHEMBL8449652

SCHEMBL8449652

COCCCCC[Si]1(c2ccccc2)CCC(C2CCC(=O)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL7758954 0.95 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8452872 0.87 ALDH1A1 (0.34) ALDH1A1
SCHEMBL7759947 0.87 RAB9A (0.34) ALDH1A1
SCHEMBL8732796 0.86 KCNH2 (0.34) ALDH1A1
SCHEMBL8454689 0.86 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7755593 0.85 KCNH2 (0.32)
SCHEMBL8916577 0.83 KDM4E (0.33) ALDH1A1
SCHEMBL8449305 0.83 MEN1 (0.32)
SCHEMBL8451929 0.82
SCHEMBL7756311 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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