SCHEMBL8655993

SCHEMBL8655993

OCCOCCOCCOc1c(I)c(OCCOCCOCCO)c(I)c(-c2c(I)c(OCCOCCOCCO)c(I)c(OCCOCCOCCO)c2I)c1I

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
MAPK1 P28482 2/20 0.42
TSHR P16473 2/20 0.42
APP P05067 5/20 0.35
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 2/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CASP1 P29466 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLCO1B3 Q9NPD5 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33
CHRM1 P11229 2/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31

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
SCHEMBL28895601 0.73 MEN1 (0.44) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL25640839 0.71 KMT2A (0.46) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL28920054 0.70 MEN1 (0.50) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL19000749 0.68 MEN1 (1.00) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL19305255 0.68 MEN1 (1.00) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL45160 0.68 MEN1 (1.00) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL12865309 0.68 MEN1 (1.00) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL12157423 0.68 MEN1 (1.00) KMT2AMEN1MAPK1TSHRAPP
Tetraethylene Glycol SCHEMBL3343601 0.68 MEN1 (1.00) KMT2AMEN1MAPK1TSHRAPP
SCHEMBL5135405 0.68 MEN1 (1.00) KMT2AMEN1MAPK1TSHRAPP

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-0731786-B1 BIPHENYL IODINATED DERIVATIVES AND THEIR DIAGNOSTIC USE BRACCO SPA (IT) 1998-10-21 EP disclosed