SCHEMBL8625007

SCHEMBL8625007

CCc1c(I)cc(C(=O)c2c(C(C)C)oc3ccc(NS(=O)(=O)C(F)(F)F)cc23)c(OCC(=O)O)c1I

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 4/20 0.34
▸ THRA P10827 3/20 0.34
▸ MAPT P10636 9/20 0.34
▸ TP53 P04637 8/20 0.34
▸ MMP12 P39900 1/20 0.32
▸ MMP13 P45452 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ HIF1A Q16665 2/20 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
SCHEMBL8624416 0.87 THRA (0.49) THRBTHRA
SCHEMBL8624230 0.86 THRA (0.48) THRBTHRAMAPTTP53MMP12
SCHEMBL8620047 0.82 THRA (0.39) THRBTHRA
SCHEMBL8622612 0.81 THRB (0.37) THRBTHRAMAPTTP53SMN1; SMN2
SCHEMBL8623584 0.79 THRA (0.49) THRBTHRAMAPTTP53MMP12
SCHEMBL8666536 0.77 MAPT (0.34) MAPTTP53MMP12MMP13SMN1; SMN2
SCHEMBL8625009 0.76 MMP12 (0.37) THRBTHRAMAPTTP53MMP12
SCHEMBL8620706 0.73 THRA (0.66) THRBTHRATP53SMN1; SMN2HIF1A
SCHEMBL8619474 0.70 THRA (0.51) THRBTHRA
SCHEMBL8666540 0.69 MMP12 (0.36) THRBTHRAMAPTTP53MMP12

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
US-5854282-A 3-benzoyl benzofuran derivatives as thyroid hormone antagonists KARO BIO AB (SE) 1998-12-29 — — US disclosed
EP-0775129-B1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KAROBIO AB (SE) 1998-10-21 — — EP disclosed
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