SCHEMBL8669213

SCHEMBL8669213

[3H]C(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
THRB P10828 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
SCHEMBL7939677 0.83 THRB (0.35) THRB
SCHEMBL19049755 0.81 THRB (0.39) THRB
SCHEMBL5375976 0.81 THRB (0.39) THRB
SCHEMBL24840638 0.79 THRB (0.36) THRB
SCHEMBL4391933 0.76
SCHEMBL8071570 0.74 LMNA (0.33)
SCHEMBL8854144 0.74 LMNA (0.33)
SCHEMBL22801424 0.73 THRB (0.37) THRB
SCHEMBL22801426 0.72 THRB (0.40) THRB
SCHEMBL12288828 0.71 TSHR (0.43) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882010-A1 PHARMACEUTICAL AGENTS CONTAINING PERFLUOROALKYL-CONTAINING METAL COMPLEXES AND THE USE THEREOF IN TUMOUR THERAPY AND INTERVENTIONAL RADIOLOGY SCHERING AKTIENGESELLSCHAFT (DE) 1998-12-09 EP disclosed
WO-1997030969-A1 PHARMACEUTICAL AGENTS CONTAINING PERFLUOROALKYL-CONTAINING METAL COMPLEXES AND THE USE THEREOF IN TUMOUR THERAPY AND INTERVENTIONAL RADIOLOGY SCHERING AKTIENGESELLSCHAFT (DE) 1997-08-28 WO disclosed