SCHEMBL8994752

SCHEMBL8994752

Oc1ccc(-c2cc(I)c(O)c(I)c2)cc1I

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.47
APP P05067 2/20 0.46
TTR P02766 2/20 0.46
ALOX5 P09917 3/20 0.39
ALB P02768 1/20 0.38
QDPR P09417 3/20 0.38
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PTPN1 P18031 1/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
ESR1 P03372 1/20 0.35

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
SCHEMBL19880348 0.90 APP (0.55) SNCAAPPALOX5QDPRCYP3A4
SCHEMBL19314123 0.82 HSD17B1 (0.55) APPCYP3A4HSD17B1HSD17B2ESR1
SCHEMBL19428392 0.82 TTR (0.65) SNCATTRALBALOX15HSD17B10
SCHEMBL13590994 0.81 ALOX5 (0.62) APPALOX5MEN1KMT2AHSD17B1
SCHEMBL326717 0.79 ALOX5 (0.64) APPALOX5CYP3A4ALOX15HSD17B10
SCHEMBL18855325 0.79 TTR (0.61) SNCATTRALBALOX15HSD17B10
SCHEMBL8994783 0.78 ESR1 (0.62) TTRALOX5MEN1KMT2AHSD17B1
SCHEMBL16317469 0.77 MAPT (0.44) APPCYP3A4ALOX15HSD17B10MEN1
SCHEMBL5493701 0.76 APP (0.41) SNCAAPPALOX5QDPRCYP3A4
SCHEMBL7929549 0.73 CRHBP (0.54) TTRALOX5ALBALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5585404-A ANTIARRHYTHMIA AGENT KARO BIO AB (SE) 1996-12-17 US disclosed
US-5567728-A BENZOYL BENZOFURAN DERIVATIVES USED TO PREVENT OR TREAT CARDIAC ARRHYTHMIA KAROBIO AKTIEBOLAG (SE) 1996-10-22 US disclosed
EP-0584186-B1 RECEPTOR LIGANDS KAROBIO AB (SE) 1996-08-21 EP disclosed
EP-0584186-A1 RECEPTOR LIGANDS. KAROBIO AB (SE) 1994-03-02 EP disclosed
WO-1992020331-A1 RECEPTOR LIGANDS KAROBIO AKTIEBOLAG (SE) 1992-11-26 WO disclosed