SCHEMBL8620047

SCHEMBL8620047

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

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 3/20 0.39
▸ THRB P10828 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.33
▸ LOXL2 Q9Y4K0 1/20 0.32
▸ NR1H4 Q96RI1 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ SLC22A12 Q96S37 1/20 0.30
▸ EYA3 Q99504 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
SCHEMBL8618893 0.84 THRA (0.56) THRATHRBALDH1A1LMNACYP2C9
SCHEMBL8621007 0.84 NR1H4 (0.36) THRATHRBKDM4ELOXL2NR1H4
SCHEMBL8625007 0.82 THRB (0.34) THRATHRB
SCHEMBL8622612 0.81 THRB (0.37) THRATHRBKDM4EALDH1A1SLC22A12
SCHEMBL8621630 0.72 THRA (0.53) THRATHRBALDH1A1LMNACYP2C9
SCHEMBL8620052 0.72 CYP2C9 (0.38) THRATHRBALDH1A1LMNACYP2C9
SCHEMBL8619759 0.71 HTT (0.35) THRATHRBKDM4ENR1H4LMNA
SCHEMBL8622283 0.70 THRA (0.56) THRATHRBALDH1A1LMNACYP2C9
SCHEMBL8624478 0.70 THRB (0.43) THRATHRBNR1H4ALDH1A1HPGD
SCHEMBL8624397 0.70 THRA (0.49) THRATHRBALDH1A1LMNACYP2C9

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 4 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
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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