SCHEMBL4647675

SCHEMBL4647675

Cc1cccc(NC(=O)C=CSc2ccccc2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.64
MMP2 P08253 4/20 0.64
MMP9 P14780 4/20 0.64
MAOB P27338 3/20 0.64
MAOA P21397 2/20 0.64
EGFR P00533 1/20 0.64
MEN1 O00255 6/20 0.53
KMT2A Q03164 6/20 0.53
MAPT P10636 3/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
ALPG P10696 1/20 0.53
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 2/20 0.49
LPAR1 Q92633 1/20 0.49
LPAR2 Q9HBW0 1/20 0.49
LMNA P02545 2/20 0.47
KCNK3 O14649 1/20 0.47
POLB P06746 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
SCHEMBL3986444 0.85 MAPT (0.56) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4648073 0.85 MAPT (0.56) MMP1MMP2MMP9MAOBMAOA
SCHEMBL9277123 0.85 MAPT (0.56) MMP1MMP2MMP9MAOBMAOA
SCHEMBL3035626 0.84 MMP1 (0.61) MMP1MMP2MMP9MAOBMAOA
SCHEMBL3035627 0.84 MMP1 (0.61) MMP1MMP2MMP9MAOBMAOA
SCHEMBL3037270 0.83 NMT1 (0.51) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4648850 0.83 MAOB (0.64) MMP1MMP2MMP9MAOBMAOA
SCHEMBL3037269 0.83 NMT1 (0.51) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4645241 0.83 MMP1 (0.64) MMP1MMP2MMP9MAOBEGFR
SCHEMBL15708843 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