SCHEMBL4648933

SCHEMBL4648933

COc1ccc(S/C=C/C(=O)Nc2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.60
MMP2 P08253 4/20 0.60
MMP9 P14780 4/20 0.60
EGFR P00533 1/20 0.60
SMN1; SMN2 Q16637 6/20 0.52
ALDH1A1 P00352 2/20 0.52
GAA P10253 2/20 0.52
HTT P42858 1/20 0.52
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
NFKB1 P19838 2/20 0.50
TGM2 P21980 1/20 0.50
KDM4E B2RXH2 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
TP53 P04637 3/20 0.49
MAPT P10636 3/20 0.49
THRB P10828 1/20 0.49

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
SCHEMBL4648935 1.00 MMP1 (0.60) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL4649079 0.94 MMP1 (0.64) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL3041662 0.88 TP53 (0.65) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL3041658 0.88 TP53 (0.65) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL3986444 0.85 MAPT (0.56) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL4648073 0.85 MAPT (0.56) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL9277123 0.85 MAPT (0.56) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL4648121 0.82 ALDH1A1 (0.67) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL4646521 0.81 MAPT (0.57) MMP1MMP2MMP9EGFRSMN1; SMN2
SCHEMBL4646526 0.81 MAPT (0.57) MMP1MMP2MMP9EGFRSMN1; SMN2

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