SCHEMBL8917334

SCHEMBL8917334

COc1ccc2c(ccc3cnn(NS(=O)(=O)c4ccccc4)c32)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
PLAU P00749 1/20 0.42
POLB P06746 3/20 0.41
HTR6 P50406 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PGR P06401 2/20 0.40
SLC40A1 Q9NP59 1/20 0.40
BCAT1 P54687 2/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GLA P06280 1/20 0.39
PKM P14618 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL8917188 0.86 PLAU (0.48) PLAUHTR6L3MBTL1PGRGAA
SCHEMBL8918137 0.80 SLC40A1 (0.40) MEN1KMT2APOLBSLC40A1KDM4E
SCHEMBL8916300 0.80 MEN1 (0.39) MEN1KMT2APLAUPOLBHTR6
SCHEMBL8917282 0.77 PLAU (0.38) PLAUSLC40A1
SCHEMBL8916165 0.76 LMNA (0.40) MEN1KMT2APLAUL3MBTL1GLA
SCHEMBL8918164 0.75 PPARG (0.41) MEN1KMT2APLAUPGRSLC40A1
SCHEMBL8694062 0.75 SLC2A1 (0.32) PLAU
SCHEMBL8916271 0.72 CA1 (0.43) MEN1KMT2APOLBHTR6L3MBTL1
SCHEMBL9229107 0.70 CA2 (0.53)
SCHEMBL8689434 0.70 ALDH1A1 (0.49) MEN1KMT2AKEAP1NFE2L2GAA

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
US-5696143-A ARTHRITIS THERAPY G.D. SEARLE & CO. 1997-12-09 US disclosed