SCHEMBL18176151

SCHEMBL18176151

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

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
TSHR P16473 3/20 0.44
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL19765645 0.99 THRB (0.46) THRBTSHRPOLBAPEX1HTT
SCHEMBL26219726 0.96 THRB (0.49) THRBTSHRPOLBAPEX1HTT
SCHEMBL11919878 0.93 TSHR (0.50) THRBTSHRPOLBAPEX1HTT
SCHEMBL19239961 0.93 TSHR (0.50) THRBTSHRPOLBAPEX1HTT
SCHEMBL17069794 0.93 TSHR (0.50) THRBTSHRPOLBAPEX1HTT
SCHEMBL2367991 0.91 THRB (0.51) THRBTSHRPOLBAPEX1HTT
SCHEMBL25602131 0.91 TSHR (0.49) THRBTSHRPOLBAPEX1HTT
SCHEMBL2367838 0.91 TSHR (0.51) THRBTSHRPOLBAPEX1HTT
SCHEMBL12373196 0.89 TSHR (0.44) THRBTSHRPOLBAPEX1HTT
SCHEMBL12759270 0.89 TSHR (0.44) THRBTSHRPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160313571-A1 INCREASED STIFFNESS CENTER OPTIC IN SOFT CONTACT LENSES FOR ASTIGMATISM CORRECTION JOHNSON & JOHNSON VISION CARE, INC. 2016-10-27 US disclosed