SCHEMBL8167209

SCHEMBL8167209

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

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
THRB P10828 1/20 0.41
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 0.36

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
SCHEMBL9001633 0.98 TSHR (0.46) TSHRTHRBPOLBAPEX1HTT
SCHEMBL9421226 0.97 TSHR (0.45) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11033007 0.93 TSHR (0.44) TSHRTHRBPOLBAPEX1HTT
SCHEMBL35807 0.92 TSHR (0.51) TSHRTHRBPOLBAPEX1HTT
SCHEMBL333002 0.90 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL5837877 0.89 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL18719914 0.88 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11312974 0.88 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11312944 0.88 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL4972438 0.88 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT

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-6087412-A OPHTHALMIC MOLDING BLEND OF MACROMOLECULE CONTAINING PHOTOINITIATOR, HYDROPHILIC VINYL MONOMER AND CROSSLINKER NOVARTIS AG (CH) 2000-07-11 US disclosed
US-5362767-A Copolymers comprising propellanes and contact lenses made therefrom CIBA-GEIGY CORPORATION (US) 1994-11-08 US disclosed
US-5264878-A Polymers and hard, gas-permeable contact lenses made therefrom CIBA-GEIGY CORPORATION (US) 1993-11-23 US disclosed
US-5196493-A Siloxane monvinyl and oligonvinyl components with fluoroacrylate and hydrophobic vinyl component having bulky hydrocarbon radical CIBA-GEIGY CORPORATION (US) 1993-03-23 US disclosed