SCHEMBL18809255

SCHEMBL18809255

O=C(O)c1c(-c2ccc(F)cc2)oc2cc(Br)c(O)cc12

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
PRNP P04156 1/20 0.56
ANO1 Q5XXA6 14/20 0.48
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41
ABCB1 P08183 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
RECQL P46063 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL18038582 0.85 MEN1 (0.52) MEN1KMT2APRNP
SCHEMBL3538490 0.83 ANO1 (0.55) MEN1KMT2APRNPANO1KDM4E
SCHEMBL1918771 0.80 ANO1 (0.45) MEN1KMT2APRNPANO1ACHE
SCHEMBL3541223 0.80 ANO1 (0.48) MEN1KMT2APRNPANO1KDM4E
SCHEMBL1918164 0.80 RAB9A (0.60) MEN1KMT2AANO1KDM4EALDH1A1
SCHEMBL27996553 0.80 KDM4E (0.51) MEN1KMT2AANO1ACHEBACE1
SCHEMBL14710224 0.78 ANO1 (0.56) MEN1KMT2AANO1KDM4EALDH1A1
SCHEMBL14709425 0.78 ANO1 (0.47) MEN1KMT2AANO1KDM4EALDH1A1
SCHEMBL2401183 0.77 ANO1 (0.45) MEN1KMT2APRNPANO1KDM4E
SCHEMBL2402437 0.76 ANO1 (0.46) ANO1

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-2970174-B1 FUSED FURANS FOR THE TREATMENT OF HEPATITIS C BRISTOL MYERS SQUIBB CO (US) 2017-05-03 EP disclosed