SCHEMBL7122010

SCHEMBL7122010

CC(C)=CCC[C@@](C)(O)CCC#N

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 6/20 0.46
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
CHRNA7 P36544 1/20 0.33
STAT3 P40763 1/20 0.33
HIF1A Q16665 1/20 0.30
EPAS1 Q99814 1/20 0.30

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
SCHEMBL7122016 1.00 ALOX15 (0.46) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL11223235 0.82 ALOX15 (0.47) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL9467505 0.75 ALOX15 (0.52) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL18102808 0.75 ALOX15 (0.52) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL15746571 0.75 ALOX15 (0.52) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL6131630 0.74
SCHEMBL11380089 0.74 ALOX15 (0.50) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL5907126 0.73 ALOX15 (0.54) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL18643950 0.73 ALOX15 (0.54) ALOX15KMT2AMEN1CYP3A4MAPK1
SCHEMBL214881 0.73 ALOX15 (0.54) ALOX15KMT2AMEN1CYP3A4MAPK1

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
JP-2003238550-A METHOD FOR PRODUCING FURANONE AND NEW INTERMEDIATE THEREFOR SHIONO KORYO KK 2003-08-27 JP disclosed