SCHEMBL10705663

SCHEMBL10705663

C=C(C(=O)OC(C)C)C(C)N

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
ADRA1A P35348 1/20 0.36
PDE4D Q08499 1/20 0.36
SLC7A5 Q01650 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL6109384 0.80 TSHR (0.43) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL5081341 0.78 TSHR (0.42) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL1895280 0.78
SCHEMBL9747131 0.76 TSHR (0.40) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL9746821 0.76 TSHR (0.40) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL9746775 0.76 TSHR (0.40) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL15641386 0.75
SCHEMBL12501862 0.74 TSHR (0.39) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL2709332 0.74 TSHR (0.48) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL4209325 0.73 CA1 (0.32) SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115010899-A Preparation method of polyurea acrylate oligomer, polyurea acrylate oligomer and application method of polyurea acrylate oligomer 浙江大学 2022-09-06 CN disclosed
CN-113583211-A Polyurea acrylate oligomer and preparation method and application method thereof 浙江大学 2021-11-02 CN disclosed
CN-1378576-A Pigment dispersions containing ABC-block polymer dispersant DU PONT (US) 2002-11-06 CN disclosed
EP-0290205-A1 Electrical storage accumulators containing electrolyte retention means SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-09 EP disclosed