SCHEMBL4648314

SCHEMBL4648314

O=C(/C=C/Sc1cccc(Cl)c1)Nc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 7/20 0.57
MMP2 P08253 7/20 0.57
MMP9 P14780 7/20 0.57
MAOB P27338 6/20 0.57
MAOA P21397 4/20 0.57
EGFR P00533 4/20 0.57
MAPT P10636 7/20 0.52
MEN1 O00255 6/20 0.52
KMT2A Q03164 6/20 0.52
NPC1 O15118 6/20 0.52
RAB9A P51151 5/20 0.52
LMNA P02545 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HTT P42858 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
NPSR1 Q6W5P4 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 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
SCHEMBL4648315 1.00 MMP1 (0.57) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4648850 0.92 MAOB (0.64) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4648278 0.89 EGFR (0.55) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4648275 0.89 EGFR (0.55) MMP1MMP2MMP9MAOBMAOA
SCHEMBL9277123 0.85 MAPT (0.56) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4648073 0.85 MAPT (0.56) MMP1MMP2MMP9MAOBMAOA
SCHEMBL3986444 0.85 MAPT (0.56) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4644727 0.84 MAPT (0.61) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4646521 0.84 MAPT (0.57) MMP1MMP2MMP9MAOBMAOA
SCHEMBL4646526 0.84 MAPT (0.57) 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