SCHEMBL9059700

SCHEMBL9059700

O=Cc1cccc(OCCOc2ccccc2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.70
MAOB P27338 8/20 0.70
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
TDP1 Q9NUW8 1/20 0.54
POLB P06746 1/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
GSK3B P49841 1/20 0.51
CCNB2 O95067 1/20 0.50
CDK1 P06493 1/20 0.50
CDK4 P11802 1/20 0.50
CCNB1 P14635 1/20 0.50
CCND1 P24385 1/20 0.50
CCNB3 Q8WWL7 1/20 0.50
SRC P12931 1/20 0.50
LCK P06239 1/20 0.49
KCNA3 P22001 1/20 0.48

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
SCHEMBL5543437 0.94 MAOA (0.66) MAOAMAOBNPC1RAB9AMEN1
SCHEMBL22181586 0.89 MAOA (0.60) MAOAMAOBNPC1RAB9AMEN1
SCHEMBL15426822 0.89 MAOA (0.60) MAOAMAOBNPC1RAB9AMEN1
SCHEMBL30724528 0.89 MAOA (0.64) MAOAMAOBNPC1RAB9AMEN1
SCHEMBL8716037 0.87 MAOA (0.62) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL8374655 0.87 MAOA (0.62) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL8374654 0.87 MAOA (0.62) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL923674 0.86 MAOA (0.71) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL30791325 0.86 MAOA (0.71) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL1662622 0.86 MAOA (0.75) MAOAMAOBNPC1RAB9AMEN1

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-1996016054-A1 CYCLOALKENYL-N-HYDROXYUREAS PFIZER PHARMACEUTICALS INC. (JP) 1996-05-30 WO disclosed