SCHEMBL5497879

SCHEMBL5497879

CC(C)c1cc(Oc2c(Cl)cc(C(=O)NCC(=O)O)cc2Cl)c(F)cc1O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRA P10827 9/20 0.45
THRB P10828 9/20 0.45
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
HIF1A Q16665 2/20 0.36

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
SCHEMBL5278943 0.87 THRA (0.45) THRATHRBCA1CA2
SCHEMBL4351634 0.81 THRA (0.47) THRATHRBHIF1A
SCHEMBL4530357 0.81 THRA (0.71) THRATHRB
SCHEMBL4360460 0.77 THRA (0.50) THRATHRBHIF1A
SCHEMBL4361873 0.75 THRA (0.48) THRATHRBHIF1A
SCHEMBL4558891 0.74 THRA (0.50) THRATHRB
SCHEMBL4351938 0.72 THRB (0.45) THRATHRBHIF1A
SCHEMBL14383356 0.72 THRA (0.67) THRATHRB
SCHEMBL5279235 0.71 THRA (0.66) THRATHRB
SCHEMBL13708075 0.70 THRB (0.65) THRATHRB

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
EP-1537073-B1 BENZAMIDE OR PHENYLACETAMIDE DERIVATIVES USEFUL AS THYROID RECEPTOR LIGANDS KAROBIO AB (SE) 2007-09-12 EP claimed