SCHEMBL4648540

SCHEMBL4648540

Cc1cccc(NC(=O)C=COc2ccccc2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 5/20 0.64
MMP2 P08253 5/20 0.64
MMP9 P14780 5/20 0.64
MAOB P27338 3/20 0.64
MAOA P21397 2/20 0.64
EGFR P00533 1/20 0.64
MAPK1 P28482 2/20 0.56
HIF1A Q16665 3/20 0.54
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
FAAH O00519 1/20 0.50
CYP3A4 P08684 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LPAR1 Q92633 1/20 0.49
LPAR2 Q9HBW0 1/20 0.49
SORT1 Q99523 1/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 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
SCHEMBL4646053 0.86 MMP1 (0.71) MMP1MMP2MMP9MAPK1HIF1A
SCHEMBL4645874 0.85 ALDH1A1 (0.57) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4646853 0.84 MGLL (0.55) MMP1MMP2MMP9HIF1AALDH1A1
SCHEMBL4645027 0.84 MMP1 (0.61) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4647915 0.83 SMN1; SMN2 (0.56) MMP1MMP2MMP9HIF1AALDH1A1
SCHEMBL4647415 0.83 HIF1A (0.47) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4648115 0.83 HIF1A (0.51) MMP1MMP2MMP9MAOBMAOA
SCHEMBL15708843 0.82 MMP1 (0.73) MMP1MMP2MMP9MAOBMAOA
SCHEMBL15708841 0.82 MMP1 (0.73) MMP1MMP2MMP9MAOBMAOA
SCHEMBL15708460 0.82 MMP1 (0.73) MMP1MMP2MMP9MAOBMAOA

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