SCHEMBL8622465

SCHEMBL8622465

CCCCc1oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2c1C(=O)c1cc(I)c(OCC(=O)O)c(I)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 1/20 0.66
▸ THRB P10828 1/20 0.66
▸ SIRT3 Q9NTG7 3/20 0.53
▸ KDM4A O75164 3/20 0.51
▸ KDM5A P29375 3/20 0.51
▸ ING2 Q9H160 1/20 0.51
▸ ABCB1 P08183 1/20 0.51

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
SCHEMBL8620054 0.93 THRA (0.65) THRATHRBSIRT3KDM4AKDM5A
SCHEMBL8621626 0.92 THRA (0.68) THRATHRBSIRT3KDM4AKDM5A
SCHEMBL8655206 0.88 THRA (0.71) THRATHRBSIRT3KDM4AKDM5A
SCHEMBL8624400 0.87 THRA (0.49) THRATHRBSIRT3
SCHEMBL8642132 0.87 THRA (0.50) THRATHRBSIRT3
SCHEMBL8619765 0.85 THRA (0.67) THRATHRBSIRT3KDM4AKDM5A
SCHEMBL8618732 0.84 THRA (0.66) THRATHRBSIRT3KDM4AKDM5A
SCHEMBL8622473 0.83 THRA (0.51) THRATHRBSIRT3
SCHEMBL8622462 0.83 THRA (0.65) THRATHRBSIRT3KDM4AKDM5A
SCHEMBL8623690 0.81 THRA (0.50) 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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