SCHEMBL4686115

SCHEMBL4686115

Cc1ccc(N)cc1.Cc1ccc(NC(=O)/C=C\Sc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 5/20 0.55
MMP2 P08253 5/20 0.55
MMP9 P14780 5/20 0.55
EGFR P00533 3/20 0.55
NMT1 P30419 1/20 0.52
DDAH1 O94760 1/20 0.51
ALDH1A1 P00352 7/20 0.51
MAPT P10636 6/20 0.51
LMNA P02545 4/20 0.51
NPSR1 Q6W5P4 2/20 0.51
MEN1 O00255 2/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51
KMT2A Q03164 2/20 0.51
RELA Q04206 2/20 0.51
TGM2 P21980 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
CCR6 P51684 1/20 0.44

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
SCHEMBL4686119 1.00 MMP1 (0.55) MMP1MMP2MMP9EGFRNMT1
SCHEMBL3035626 0.93 MMP1 (0.61) MMP1MMP2MMP9EGFRNMT1
SCHEMBL3035627 0.93 MMP1 (0.61) MMP1MMP2MMP9EGFRNMT1
SCHEMBL4648073 0.83 MAPT (0.56) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL3986444 0.83 MAPT (0.56) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL9277123 0.83 MAPT (0.56) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL3037269 0.81 NMT1 (0.51) MMP1MMP2MMP9EGFRNMT1
SCHEMBL3037270 0.81 NMT1 (0.51) MMP1MMP2MMP9EGFRNMT1
SCHEMBL4648144 0.81 EGFR (0.64) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL9989205 0.81 EGFR (0.64) MMP1MMP2MMP9EGFRALDH1A1

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