SCHEMBL11037779

SCHEMBL11037779

C=C(C)C(=O)OC1([SiH3])CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
TSHR P16473 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
SCHEMBL1930428 0.83 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL15453572 0.78 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL28614103 0.78 ALDH1A1 (0.37) ALDH1A1TSHR
SCHEMBL685576 0.78 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL685580 0.78 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL487008 0.78 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL6912158 0.78 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL17245073 0.78 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL1832545 0.78 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL74808 0.78 ALDH1A1 (0.39) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0115531-A1 SILOXANE-CONTAINING POLYMERS AND CONTACT LENSES THEREFROM POLYMATIC INVESTMENT CORPORATION N.V. (AN) 1984-08-15 EP disclosed
WO-1984000763-A1 SILOXANE-CONTAINING POLYMERS AND CONTACT LENSES THEREFROM POLYMATIC INVESTMENT CORP NV (NL) 1984-03-01 WO disclosed