SCHEMBL10752198

SCHEMBL10752198

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

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
THRB P10828 1/20 0.43
ACHE P22303 14/20 0.42

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
SCHEMBL21404644 0.95 TSHR (0.50) TSHRTHRBACHE
SCHEMBL21404702 0.94 THRB (0.50) TSHRTHRBACHE
SCHEMBL21404694 0.94 THRB (0.50) TSHRTHRBACHE
SCHEMBL5925097 0.92 ACHE (0.45) TSHRTHRBACHE
SCHEMBL20149751 0.91 ACHE (0.41) TSHRTHRBACHE
SCHEMBL631551 0.90 ACHE (0.49) TSHRTHRBACHE
SCHEMBL21404678 0.90 ACHE (0.50) TSHRTHRBACHE
SCHEMBL21404684 0.90 ACHE (0.50) TSHRTHRBACHE
SCHEMBL21404622 0.89 THRB (0.48) TSHRTHRBACHE
SCHEMBL21404651 0.89 THRB (0.48) TSHRTHRBACHE

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-4711943-A IMPROVED OXYGEN PERMEABILITY AND STABILITY SOLA U.S.A. INC. (US) 1987-12-08 US disclosed