SCHEMBL11802468

SCHEMBL11802468

C=C(C)C(=O)OC(O)(OCC)C(OCC)OCC

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
TSHR P16473 3/20 0.34
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL9357202 0.79 ALDH1A1 (0.35) THRBTSHRALDH1A1
SCHEMBL9487660 0.75 THRB (0.36) THRB
SCHEMBL11805468 0.75 THRB (0.33) THRBTSHR
SCHEMBL3705484 0.75 TSHR (0.39) THRBTSHRALDH1A1
SCHEMBL27527922 0.75 THRB (0.37) THRBTSHRALDH1A1
SCHEMBL1019164 0.73 THRB (0.36) THRBTSHRALDH1A1
SCHEMBL11219958 0.73 THRB (0.41) THRBTSHRALDH1A1
SCHEMBL28436042 0.72 THRB (0.44) THRBTSHRALDH1A1
SCHEMBL10455143 0.72 TSHR (0.37) THRBTSHRALDH1A1
SCHEMBL15901829 0.72 THRB (0.40) THRBTSHRALDH1A1

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-3935342-A POLYMERIZATION WITH AN UNSATURATED SILYL MONOMER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-01-27 US disclosed