SCHEMBL8558271

SCHEMBL8558271

O=C=Nc1cc(OCc2ccccc2)cc(OCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
MAOB P27338 7/20 0.47
MAOA P21397 2/20 0.47
ALOX5 P09917 1/20 0.46
BCHE P06276 2/20 0.45
GSTP1 P09211 1/20 0.45
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
PTGS1 P23219 1/20 0.44
SLC6A2 P23975 1/20 0.44
CYP2C19 P33261 1/20 0.44
PTGS2 P35354 1/20 0.44
SLC6A3 Q01959 1/20 0.44
HIF1A Q16665 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
NR4A2 P43354 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44

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
SCHEMBL19344687 0.97 MEN1 (0.50) MEN1KMT2AMAOBMAOAALOX5
SCHEMBL1333722 0.87 MAOB (0.56) MAOBMAOAALOX5BCHECYP4F2
SCHEMBL241348 0.85 LMNA (0.55) MEN1KMT2AMAOBMAOABCHE
SCHEMBL11387676 0.81 CYP3A4 (0.53) MEN1KMT2AMAOBMAOABCHE
SCHEMBL14660991 0.81 MAOB (0.49) MAOBMAOABCHECYP4F2CYP4A11
SCHEMBL4674930 0.80 MEN1 (0.70) MEN1KMT2AMAOBMAOAALOX5
SCHEMBL10735742 0.80 MEN1 (0.46) MEN1KMT2AMAOBMAOAALOX5
SCHEMBL28185132 0.77 MEN1 (0.59) MEN1KMT2AMAOBMAOAALOX5
SCHEMBL5172920 0.75 CYP3A4 (0.59) MAOBBCHECYP1A2PPARG
SCHEMBL15902884 0.75 MRGPRX4 (0.46) MEN1KMT2AMAOBMAOAALOX5

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-5795907-A Gastin and CCK receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 1998-08-18 US disclosed