SCHEMBL8666536

SCHEMBL8666536

CCc1c(I)cc(C(OCC(=O)O)c2c(C(C)C)oc3ccc(NS(=O)(=O)C(F)(F)F)cc23)cc1I

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.34
▸ TP53 P04637 3/20 0.34
▸ MMP12 P39900 2/20 0.33
▸ MMP13 P45452 2/20 0.33
▸ HIF1A Q16665 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ HSPD1 P10809 1/20 0.31
▸ HSPE1 P61604 1/20 0.31
▸ PFKFB3 Q16875 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL8625007 0.77 THRB (0.34) MAPTTP53MMP12MMP13HIF1A
SCHEMBL8623584 0.76 THRA (0.49) MAPTTP53MMP12MMP13HIF1A
SCHEMBL8624230 0.74 THRA (0.48) MAPTTP53MMP12MMP13SMN1; SMN2
SCHEMBL8617759 0.72 HSPD1 (0.37) MAPTTP53MMP12MMP13HIF1A
SCHEMBL8666540 0.71 MMP12 (0.36) MAPTTP53MMP12MMP13HIF1A
SCHEMBL8624288 0.69 HSPD1 (0.39) MAPTTP53MMP12MMP13HIF1A
SCHEMBL8625009 0.69 MMP12 (0.37) MAPTTP53MMP12MMP13HIF1A
SCHEMBL8623799 0.67 MAPT (0.45) MAPTTP53SMN1; SMN2HSPD1HSPE1
SCHEMBL8624416 0.67 THRA (0.49) —
SCHEMBL8620706 0.64 THRA (0.66) TP53HIF1ASMN1; SMN2MAPK1

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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