SCHEMBL4648316

SCHEMBL4648316

O=C(C=COc1ccccc1)Nc1ccc(F)cc1

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
ALDH1A1 P00352 5/20 0.54
TGM2 P21980 2/20 0.50
POLB P06746 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
TP53 P04637 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPT P10636 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
LPAR1 Q92633 1/20 0.47
LPAR2 Q9HBW0 1/20 0.47
LPAR3 Q9UBY5 1/20 0.47
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL4645874 0.89 ALDH1A1 (0.57) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4645027 0.85 MMP1 (0.61) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4648924 0.85 ALDH1A1 (0.58) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4644760 0.85 ALDH1A1 (0.54) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4648510 0.84 ALDH1A1 (0.66) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4646849 0.84 MMP1 (0.68) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4644758 0.83 KMT2A (0.68) ALDH1A1TGM2TDP1MAPTKMT2A
SCHEMBL4647932 0.82 MAPT (0.54) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4649121 0.82 ALDH1A1 (0.51) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL4647079 0.82 MAPT (0.54) 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