SCHEMBL8620054

SCHEMBL8620054

CCCCc1oc2ccc(NC(=O)c3ccc(OC)cc3)cc2c1C(=O)c1cc(I)c(OCC(=O)O)c(I)c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 1/20 0.65
▸ THRB P10828 1/20 0.65
▸ KDM4A O75164 3/20 0.51
▸ KDM5A P29375 3/20 0.51
▸ ING2 Q9H160 1/20 0.51
▸ ABCB1 P08183 1/20 0.51
▸ SIRT3 Q9NTG7 3/20 0.50

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
SCHEMBL8622465 0.93 THRA (0.66) THRATHRBKDM4AKDM5AING2
SCHEMBL8619765 0.92 THRA (0.67) THRATHRBKDM4AKDM5AING2
SCHEMBL8618732 0.91 THRA (0.66) THRATHRBKDM4AKDM5AING2
SCHEMBL8622473 0.91 THRA (0.51) THRATHRBSIRT3
SCHEMBL8623690 0.88 THRA (0.50) THRATHRBSIRT3
SCHEMBL8623692 0.87 THRA (0.47) THRATHRBKDM4AKDM5AING2
SCHEMBL8655206 0.87 THRA (0.71) THRATHRBKDM4AKDM5AING2
SCHEMBL8621626 0.85 THRA (0.68) THRATHRBKDM4AKDM5AING2
SCHEMBL8617561 0.85 THRB (0.47) THRATHRB
SCHEMBL8620714 0.84 THRA (0.45) THRATHRBSIRT3

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 8 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 claimed
EP-0775129-B1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KAROBIO AB (SE) 1998-10-21 — — EP claimed
EP-0775129-A1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KARO BIO AB (SE) 1997-05-28 — — EP claimed
WO-1996005190-A1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KARO BIO AB (SE) 1996-02-22 — — WO claimed
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
EP-0775129-A1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KARO BIO AB (SE) 1997-05-28 — — EP disclosed
WO-1996005190-A1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KARO BIO AB (SE) 1996-02-22 — — WO disclosed
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