SCHEMBL4647079

SCHEMBL4647079

CC(=O)c1ccc(NC(=O)C=COc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
SMN1; SMN2 Q16637 5/20 0.54
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
TAAR1 Q96RJ0 1/20 0.54
ALDH1A1 P00352 5/20 0.51
LMNA P02545 2/20 0.51
HIF1A Q16665 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
KMT2A Q03164 4/20 0.49
MEN1 O00255 2/20 0.49
GAA P10253 2/20 0.48
HPGD P15428 1/20 0.48
TP53 P04637 1/20 0.48
EGFR P00533 2/20 0.48
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
THRB P10828 1/20 0.47
NFKB1 P19838 1/20 0.47

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
SCHEMBL4647932 1.00 MAPT (0.54) MAPTSMN1; SMN2RAB9ANPC1TAAR1
SCHEMBL4648510 0.87 ALDH1A1 (0.66) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4645874 0.86 ALDH1A1 (0.57) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4645027 0.85 MMP1 (0.61) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4646849 0.84 MMP1 (0.68) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4644760 0.82 ALDH1A1 (0.54) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4648316 0.82 MMP1 (0.61) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4648924 0.82 ALDH1A1 (0.58) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4646880 0.82 EGFR (0.64) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4647116 0.82 MMP1 (0.57) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957459-A2 IMINOPROPENE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-08-20 EP disclosed
WO-2007063702-A2 IMINOPROPENE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-07 WO disclosed