SCHEMBL9745980

SCHEMBL9745980

C=C(C(=O)OC(C)C)C(Br)(Br)CBr

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.35
PDE4D Q08499 1/20 0.35
TSHR P16473 3/20 0.33
XPO1 O14980 2/20 0.32
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL9745594 0.79 ADRA1A (0.39) ADRA1APDE4DTSHRXPO1GAA
SCHEMBL9745783 0.79 ADRA1A (0.39) ADRA1APDE4DTSHRXPO1GAA
SCHEMBL9746150 0.78 ALDH1A1 (0.41)
SCHEMBL9746804 0.74 ALDH1A1 (0.42) TSHRGAA
SCHEMBL9747666 0.73 TSHR (0.40) ADRA1APDE4DTSHRGAASMN1; SMN2
SCHEMBL1958622 0.71 TSHR (0.39) ADRA1APDE4DTSHRXPO1GAA
SCHEMBL9746238 0.71 TSHR (0.39) ADRA1APDE4DTSHRGAASMN1; SMN2
SCHEMBL9745606 0.71 TSHR (0.39) ADRA1APDE4DTSHRXPO1GAA
SCHEMBL9745639 0.71 TSHR (0.39) ADRA1APDE4DTSHRGAASMN1; SMN2
SCHEMBL9747242 0.69 TSHR (0.37) ADRA1APDE4DTSHRXPO1GAA

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