SCHEMBL9747618

SCHEMBL9747618

C=C(C(=O)OC(C)C)C(F)C(F)F

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
ADRA1A P35348 1/20 0.34
PDE4D Q08499 1/20 0.34
HCAR2 Q8TDS4 1/20 0.30
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9746821 0.82 TSHR (0.40) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL9545996 0.77 ALDH1A1 (0.44)
SCHEMBL6109384 0.77 TSHR (0.43) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL9746170 0.75 TSHR (0.34) TSHRADRA1APDE4D
SCHEMBL5081341 0.75 TSHR (0.42) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL10705663 0.73 TSHR (0.40) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL9747131 0.73 TSHR (0.40) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL9746775 0.73 TSHR (0.40) TSHRADRA1APDE4DHCAR2GAA
SCHEMBL9546128 0.72 ALDH1A1 (0.44) TSHRGAASMN1; SMN2
SCHEMBL5146416 0.72

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-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed