SCHEMBL27875083

SCHEMBL27875083

C=C(C)C(=O)OC.C=C[Si](OC)(OC)OC

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
TSHR P16473 1/20 0.36
THRB P10828 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
SCHEMBL27858743 0.84 ALDH1A1 (0.58) ALDH1A1TSHR
SCHEMBL27817728 0.82 ALDH1A1 (0.75) ALDH1A1TSHRTHRB
Acetone SCHEMBL9580337 0.82 ALDH1A1 (0.38) ALDH1A1
SCHEMBL5597758 0.81 ALDH1A1 (0.54) ALDH1A1TSHRTHRB
SCHEMBL8150214 0.81 ALDH1A1 (0.36) ALDH1A1
Butadiene SCHEMBL347876 0.80 ALDH1A1 (0.79) ALDH1A1TSHRTHRB
SCHEMBL344339 0.80 ALDH1A1 (0.79) ALDH1A1TSHRTHRB
Acetic Acid SCHEMBL29153474 0.80 FFAR3 (0.37) ALDH1A1
Propene SCHEMBL27204800 0.80 ALDH1A1 (0.79) ALDH1A1TSHRTHRB
Butadiene SCHEMBL27001 0.80 ALDH1A1 (0.79) ALDH1A1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107352856-B A kind of airfield pavement patching material and preparation method thereof 山东建筑大学 2019-11-26 CN disclosed
CN-107352856-A A kind of airfield pavement patching material and preparation method thereof 滨州学院 2017-11-17 CN disclosed
CN-102504085-A Solvent thermal polymerization method of methyl methacrylate-silicane copolymer UNIV SHANGHAI JIAOTONG 2012-06-20 CN disclosed