SCHEMBL4606819

SCHEMBL4606819

OCCc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PCNA P12004 9/20 0.72
THRB P10828 8/20 0.72
THRA P10827 6/20 0.72
POLB P06746 3/20 0.72
HIF1A Q16665 3/20 0.72
MAPK1 P28482 1/20 0.72
LMNA P02545 4/20 0.67
ABCB11 O95342 2/20 0.67
GABRA1 P14867 2/20 0.67
PPARG P37231 2/20 0.67
GABRA2 P47869 2/20 0.67
GABRB2 P47870 2/20 0.67
HPGD P15428 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
HSD17B10 Q99714 2/20 0.67
CYP1A2 P05177 1/20 0.67
PGR P06401 1/20 0.67
CHRM2 P08172 1/20 0.67
HTR1A P08908 1/20 0.67
ADRA2A P08913 1/20 0.67

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
SCHEMBL7087278 0.89 THRB (0.68) PCNATHRBTHRAPOLBHIF1A
SCHEMBL12921186 0.88 THRB (0.68) PCNATHRBTHRAPOLBHIF1A
SCHEMBL14264009 0.88 THRB (0.68) PCNATHRBTHRAPOLBHIF1A
SCHEMBL14292277 0.85 THRB (0.68) PCNATHRBTHRAPOLBHIF1A
SCHEMBL22103797 0.85 THRB (0.65) PCNATHRBTHRAPOLBHIF1A
SCHEMBL14264008 0.84 THRB (0.67) PCNATHRBTHRAPOLBHIF1A
Thyropropic Acid SCHEMBL310201 0.84 PCNA (1.00) PCNATHRBTHRAPOLBHIF1A
SCHEMBL14230042 0.84 PCNA (0.64) PCNATHRBTHRAPOLBHIF1A
SCHEMBL281910 0.83 THRB (0.76) PCNATHRBTHRAPOLBHIF1A
SCHEMBL6825136 0.82 THRB (0.85) PCNATHRBTHRAPOLBHIF1A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0831769-B2 NOVEL USES FOR THYROID HORMONES OR THYROID HORMONE-LIKE COMPOUNDS LAVIN DR THOMAS N (US) 2008-07-23 EP claimed