SCHEMBL10611147

SCHEMBL10611147

O=C(Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)NCCn1ccnc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 5/20 0.51
▸ THRA P10827 4/20 0.51
▸ PPARG P37231 4/20 0.51
▸ RXRA P19793 3/20 0.51
▸ ITGB3 P05106 1/20 0.51
▸ ITGAV P06756 1/20 0.51
▸ PCNA P12004 4/20 0.45
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ ADORA3 P0DMS8 3/20 0.42
▸ PDE4D Q08499 3/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ TTR P02766 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ HTR1A P08908 2/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ HTR2B P41595 2/20 0.42
▸ PGR P06401 2/20 0.42
▸ ALDH1A1 P00352 2/20 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
SCHEMBL10609147 0.80 PCNA (0.55) THRBTHRAPPARGRXRAPCNA
SCHEMBL1525946 0.70 THRB (0.73) THRBTHRAPPARGRXRAITGB3
SCHEMBL13949709 0.69 THRB (0.77) THRBTHRAPPARGRXRAITGB3
Tetrac SCHEMBL365951 0.69 THRB (1.00) THRBTHRAPPARGRXRAITGB3
SCHEMBL15014468 0.68 KDM4E (0.55) MEN1KMT2AHSD17B10CYP1A2CYP2C9
SCHEMBL12781709 0.68 GAA (0.74) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL16610099 0.68 EGLN3 (0.58) LMNAHSD17B10CYP1A2CYP2C9ALDH1A1
SCHEMBL1526151 0.67 THRB (0.60) THRBTHRAPPARGRXRAITGB3
SCHEMBL16124442 0.66 PCNA (0.69) THRBTHRAPPARGRXRAPCNA
SCHEMBL9236717 0.66 QPCT (0.57) HSD17B10CYP1A2ALDH1A1CYP3A4ALOX15

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
Send feedback