SCHEMBL5385598

SCHEMBL5385598

COC(=O)Cc1cc(Cl)c(Oc2ccc(N)c(Cl)c2)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 17/20 0.49
▸ THRA P10827 16/20 0.49
▸ ALDH1A1 P00352 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ HSP90AB1 P08238 1/20 0.42
▸ LMNA P02545 1/20 0.41

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
SCHEMBL5388207 0.92 THRB (0.49) THRBTHRAALDH1A1GAAGFER
SCHEMBL5386441 0.89 THRB (0.56) THRBTHRAALDH1A1GAAGFER
SCHEMBL3923780 0.86 THRA (0.55) THRBTHRAALDH1A1GAAGFER
SCHEMBL5393458 0.86 THRB (0.49) THRBTHRAALDH1A1GAAGFER
SCHEMBL5396340 0.85 THRA (0.43) THRBTHRAALDH1A1GAAGFER
SCHEMBL2434505 0.83 ALDH1A1 (0.64) ALDH1A1GAAGFERHSP90AB1LMNA
Hydrochloric Acid SCHEMBL6560031 0.82 ALDH1A1 (0.62) ALDH1A1GAAGFERHSP90AB1LMNA
SCHEMBL5742868 0.81 THRB (0.57) THRBTHRAHSP90AB1LMNA
SCHEMBL3914044 0.80 THRA (0.50) THRBTHRAALDH1A1GAALMNA
SCHEMBL5385620 0.78 THRB (0.67) THRBTHRA

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-7199265-B2 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2007-04-03 — — US disclosed
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