SCHEMBL7045902

SCHEMBL7045902

O=Cc1ccc(O)c(Br)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 10/20 0.48
TRIM24 O15164 2/20 0.40
TRIM33 Q9UPN9 2/20 0.40
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KMT2A Q03164 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HSP90AA1 P07900 1/20 0.37
IDO1 P14902 1/20 0.37
TYR P14679 2/20 0.36

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
SCHEMBL31359160 0.83 ERN1 (0.52) ERN1TRIM24TRIM33MEN1NPC1
SCHEMBL27657430 0.83 ERN1 (0.52) ERN1TRIM24TRIM33MEN1NPC1
SCHEMBL31300223 0.80 ERN1 (0.54) ERN1TRIM24TRIM33TDP1MEN1
SCHEMBL4617412 0.80 ERN1 (0.54) ERN1TRIM24TRIM33MEN1NPC1
SCHEMBL219677 0.80 ERN1 (0.54) ERN1TRIM24TRIM33TDP1MEN1
SCHEMBL1982095 0.78 ERN1 (0.52) ERN1TRIM24TRIM33TDP1MEN1
SCHEMBL29915579 0.78 ERN1 (0.52) ERN1TRIM24TRIM33TDP1MEN1
SCHEMBL3842233 0.78 TDP1 (0.45) ERN1TRIM24TRIM33TDP1MEN1
Hydrochloric Acid SCHEMBL29595412 0.77 ERN1 (0.50) ERN1TRIM24TRIM33TDP1MEN1
SCHEMBL15195884 0.77 ERN1 (0.50) ERN1TRIM24TRIM33MEN1NPC1

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
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 WO disclosed