SCHEMBL11276369

SCHEMBL11276369

C=C(C)C(=O)OCCC[Si]([Si](C)(O[SiH2]O[Si](C)(C)C)O[Si](C)(C)C)([Si](C)(O[SiH2]O[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(O[SiH2]O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
THRB P10828 1/20 0.36
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL11278056 0.94 TSHR (0.38) TSHRPOLBAPEX1HTTTDP1
SCHEMBL11293409 0.91 TSHR (0.36) TSHRPOLBAPEX1HTTTDP1
SCHEMBL9421229 0.88 TSHR (0.40) TSHRPOLBAPEX1HTTTDP1
SCHEMBL11291860 0.88 TSHR (0.40) TSHRPOLBAPEX1HTTTDP1
SCHEMBL9862364 0.83 TSHR (0.44) TSHRTHRBALDH1A1
SCHEMBL7609199 0.79 TSHR (0.49) TSHRPOLBAPEX1HTTTDP1
SCHEMBL12094871 0.75 TSHR (0.51) TSHRPOLBAPEX1HTTTDP1
SCHEMBL214065 0.75 TSHR (0.51) TSHRPOLBAPEX1HTTTDP1
SCHEMBL35807 0.75 TSHR (0.51) TSHRPOLBAPEX1HTTTDP1
SCHEMBL35612 0.75 TSHR (0.51) TSHRPOLBAPEX1HTTTDP1

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
EP-0067909-A1 Oxygen permeable hard and semi-hard contact lens compositions, processes for their preparation, contact lenses and their manufacture from such compositions SYNTEX (U.S.A.) INC. (US) 1982-12-29 EP claimed
US-4242483-A FROM AN UNSATURATED SILICON CONTAINING MONOMER AND AN ACRYLIC OR METHACRYLIC ESTER OR ITACONATE ESTER SYNTEX OPHTHALMICS, INC., 1980-12-30 US claimed
EP-0067909-A1 Oxygen permeable hard and semi-hard contact lens compositions, processes for their preparation, contact lenses and their manufacture from such compositions SYNTEX (U.S.A.) INC. (US) 1982-12-29 EP disclosed
US-4242483-A FROM AN UNSATURATED SILICON CONTAINING MONOMER AND AN ACRYLIC OR METHACRYLIC ESTER OR ITACONATE ESTER SYNTEX OPHTHALMICS, INC., 1980-12-30 US disclosed