SCHEMBL4684535

SCHEMBL4684535

S=C(C=Cc1ccccc1)Nc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.61
MMP2 P08253 6/20 0.61
MMP9 P14780 6/20 0.61
EGFR P00533 4/20 0.61
MAOB P27338 3/20 0.61
MAOA P21397 1/20 0.61
GAA P10253 2/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
NOX1 Q9Y5S8 1/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
TAS2R38 P59533 3/20 0.50
ALDH1A1 P00352 2/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP3A4 P08684 1/20 0.50
DEGS1 O15121 1/20 0.50

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
SCHEMBL4684531 1.00 MMP1 (0.61) MMP1MMP2MMP9EGFRMAOB
SCHEMBL3073560 0.81 HDAC2 (0.57) MMP1MMP2MMP9EGFRMAOB
SCHEMBL10470695 0.78 TDP1 (0.50) MMP1MMP2MMP9EGFRMAOB
SCHEMBL10470696 0.78 TDP1 (0.50) MMP1MMP2MMP9EGFRMAOB
SCHEMBL27657876 0.78 MMP1 (0.63) MMP1MMP2MMP9EGFRMAOB
SCHEMBL4625195 0.76 MMP1 (0.61) MMP1MMP2MMP9EGFRMAOB
N-Phenylcinnamamide SCHEMBL3667414 0.76 MMP1 (1.00) MMP1MMP2MMP9EGFRMAOB
N-Phenylcinnamamide SCHEMBL4205896 0.76 MMP1 (1.00) MMP1MMP2MMP9EGFRMAOB
SCHEMBL7113650 0.76 MMP1 (0.61) MMP1MMP2MMP9EGFRMAOB
SCHEMBL3074580 0.76 GAA (0.52) MAOBMAOAGAAKMT2AMEN1

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