SCHEMBL5309245

SCHEMBL5309245

O=C(O)CNC(=O)c1c(O)c2cc(OCc3ccccc3)cc(Cc3ccccc3)c2[nH]c1=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
RXFP1 Q9HBX9 1/20 0.45
NPC1 O15118 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
EGLN1 Q9GZT9 4/20 0.42
HIF1A Q16665 4/20 0.42
THRA P10827 3/20 0.42
THRB P10828 3/20 0.42
KDM4E B2RXH2 2/20 0.39
DPYD Q12882 1/20 0.39
SPHK2 Q9NRA0 1/20 0.39
MMP13 P45452 1/20 0.38

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
SCHEMBL5308604 0.90 MEN1 (0.43) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL5308388 0.89 THRA (0.48) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL5312251 0.84 MEN1 (0.48) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL5312400 0.84 MEN1 (0.48) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL15846440 0.83 HIF1A (0.49) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL5312539 0.81 MEN1 (0.46) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL15846776 0.81 MEN1 (0.56) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL5309396 0.78 EGLN1 (0.43) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL15846836 0.78 MEN1 (0.40) MEN1KMT2ARXFP1NPC1PKM
SCHEMBL15845949 0.78 MEN1 (0.43) MEN1KMT2ARXFP1NPC1PKM

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-2007038571-A2 PROLYL HYDROXYLASE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-05 WO claimed