SCHEMBL4646526

SCHEMBL4646526

O=C(C=CSc1ccc(Cl)cc1)Nc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
MMP1 P03956 6/20 0.57
MMP2 P08253 6/20 0.57
MMP9 P14780 6/20 0.57
ALDH1A1 P00352 5/20 0.57
EGFR P00533 4/20 0.57
NPSR1 Q6W5P4 3/20 0.57
LMNA P02545 3/20 0.57
MAOB P27338 4/20 0.50
NPC1 O15118 3/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
RAB9A P51151 2/20 0.50
HTT P42858 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAOA P21397 2/20 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
SCHEMBL4646521 1.00 MAPT (0.57) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL4644727 0.94 MAPT (0.61) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL3986444 0.89 MAPT (0.56) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL4648073 0.89 MAPT (0.56) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL9277123 0.89 MAPT (0.56) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL4648275 0.87 EGFR (0.55) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL4648278 0.87 EGFR (0.55) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL4649065 0.85 MMP1 (0.57) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL4649072 0.85 MMP1 (0.57) MAPTMMP1MMP2MMP9ALDH1A1
SCHEMBL4648850 0.84 MAOB (0.64) MAPTMMP1MMP2MMP9ALDH1A1

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