SCHEMBL9522071

SCHEMBL9522071

O=C(O)COc1cc(I)c(O)c(I)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.56
THRB P10828 3/20 0.56
PPARG P37231 2/20 0.56
ITGB3 P05106 1/20 0.56
ITGAV P06756 1/20 0.56
RXRA P19793 1/20 0.56
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.49
HPGD P15428 1/20 0.49
PTPRB P23467 1/20 0.49
LMNA P02545 1/20 0.49
MCL1 Q07820 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PTPN7 P35236 1/20 0.46
ALDH1A1 P00352 2/20 0.43
PPARD Q03181 1/20 0.43
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TSHR P16473 2/20 0.42
NR4A1 P22736 1/20 0.42

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
SCHEMBL28645298 0.80 ALOX15 (0.65) THRATHRBPPARGALOX15HSD17B10
SCHEMBL6516217 0.80 HPGD (0.62) THRATHRBALOX15HSD17B10HPGD
SCHEMBL6720881 0.77 THRB (0.49) THRATHRBPPARGITGB3ITGAV
SCHEMBL6725180 0.77 THRB (0.55) THRATHRBPPARGITGB3ITGAV
SCHEMBL3138757 0.76 ALOX15 (0.50) THRATHRBALOX15HSD17B10HPGD
SCHEMBL19745145 0.76 ALOX15 (0.50) THRATHRBALOX15HSD17B10HPGD
SCHEMBL4402699 0.76 GPR55 (0.55) THRATHRBALOX15HSD17B10HPGD
SCHEMBL1613109 0.75 HPGD (0.56) THRATHRBALOX15HSD17B10HPGD
SCHEMBL5124637 0.75 LMNA (0.72) THRATHRBPPARGALOX15HSD17B10
SCHEMBL5387851 0.75 LMNA (0.56) THRATHRBALOX15HSD17B10HPGD

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-5273885-A Using a polyiodothyronine analog of a phenyl compound containing a hydroxyl group ortho to an iodine SYNTEX (U.S.A.) INC. (US) 1993-12-28 US disclosed
EP-0533744-A1 HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS BIOCHEM PHARMA INC. (CA) 1993-03-31 EP disclosed