SCHEMBL9746170

SCHEMBL9746170

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

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
ADRA1A P35348 1/20 0.32
PDE4D Q08499 1/20 0.32
XPO1 O14980 2/20 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
SCHEMBL9745667 0.79 ALDH1A1 (0.41)
SCHEMBL9746821 0.79 TSHR (0.40) TSHRADRA1APDE4D
SCHEMBL9747383 0.76 ALDH1A1 (0.42) TSHR
SCHEMBL9747618 0.75 TSHR (0.37) TSHRADRA1APDE4D
SCHEMBL6109384 0.73 TSHR (0.43) TSHRADRA1APDE4D
SCHEMBL9745747 0.72 TSHR (0.39) TSHRADRA1APDE4DXPO1
SCHEMBL5081341 0.72 TSHR (0.42) TSHRADRA1APDE4D
SCHEMBL9746775 0.70 TSHR (0.40) TSHRADRA1APDE4D
SCHEMBL10705663 0.70 TSHR (0.40) TSHRADRA1APDE4D
SCHEMBL9747131 0.70 TSHR (0.40) TSHRADRA1APDE4D

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