SCHEMBL8666540

SCHEMBL8666540

CCC(Oc1c(I)cc(Cc2c(C(C)C)oc3ccc(NS(=O)(=O)C(F)(F)F)cc23)cc1I)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MMP12 P39900 5/20 0.36
▸ MMP13 P45452 5/20 0.36
▸ THRA P10827 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ PTPN1 P18031 1/20 0.33
▸ HIF1A Q16665 3/20 0.33
▸ MAPT P10636 5/20 0.32
▸ TP53 P04637 4/20 0.32
▸ HSPD1 P10809 1/20 0.31
▸ HSPE1 P61604 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL8625009 0.86 MMP12 (0.37) MMP12MMP13THRATHRBHIF1A
SCHEMBL8623584 0.86 THRA (0.49) MMP12MMP13THRATHRBHIF1A
SCHEMBL8617759 0.85 HSPD1 (0.37) MMP12MMP13HIF1AMAPTTP53
SCHEMBL8624288 0.78 HSPD1 (0.39) MMP12MMP13HIF1AMAPTTP53
SCHEMBL8624417 0.77 THRA (0.48) THRATHRB
SCHEMBL8623799 0.76 MAPT (0.45) PTPN1MAPTTP53HSPD1HSPE1
SCHEMBL8624230 0.72 THRA (0.48) MMP12MMP13THRATHRBMAPT
SCHEMBL8666536 0.71 MAPT (0.34) MMP12MMP13HIF1AMAPTTP53
SCHEMBL8625007 0.69 THRB (0.34) MMP12MMP13THRATHRBHIF1A
SCHEMBL8622615 0.67 MAPT (0.40) MMP12THRBMAPTTP53POLB

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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