SCHEMBL10609147

SCHEMBL10609147

O=C(CCc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)NCCn1ccnc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PCNA P12004 13/20 0.55
▸ THRB P10828 7/20 0.55
▸ THRA P10827 5/20 0.55
▸ POLB P06746 3/20 0.55
▸ HIF1A Q16665 3/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ LMNA P02545 4/20 0.47
▸ ABCB11 O95342 2/20 0.47
▸ GABRA1 P14867 2/20 0.47
▸ PPARG P37231 2/20 0.47
▸ GABRA2 P47869 2/20 0.47
▸ GABRB2 P47870 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ PGR P06401 1/20 0.47
▸ CHRM2 P08172 1/20 0.47
▸ HTR1A P08908 1/20 0.47
▸ ADRA2A P08913 1/20 0.47

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
SCHEMBL10611147 0.80 THRB (0.51) PCNATHRBTHRAPOLBHIF1A
SCHEMBL10610249 0.78 PCNA (0.72) PCNATHRBTHRAPOLBHIF1A
Thyropropic Acid SCHEMBL310201 0.73 PCNA (1.00) PCNATHRBTHRAPOLBHIF1A
SCHEMBL14485275 0.71 PCNA (1.00) PCNATHRBTHRAPOLBHIF1A
SCHEMBL14485260 0.70 PCNA (0.74) PCNATHRBTHRAPOLBHIF1A
SCHEMBL16610099 0.69 EGLN3 (0.58) LMNASMN1; SMN2HSD17B10CYP1A2CYP2C9
SCHEMBL16124470 0.69 PCNA (0.82) PCNATHRBTHRAPOLBHIF1A
SCHEMBL16124429 0.69 PCNA (0.66) PCNATHRBTHRAPOLBHIF1A
SCHEMBL4606819 0.68 PCNA (0.72) PCNATHRBTHRAPOLBHIF1A
SCHEMBL6825136 0.68 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
US-4741897-A Thyroxine analogs and reagents for thyroid hormone assays BAXTER TRAVENOL (US) 1988-05-03 — — US disclosed
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