SCHEMBL4648115

SCHEMBL4648115

CC(C)c1cccc(NC(=O)C=COc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.51
TRPV1 Q8NER1 1/20 0.51
MMP1 P03956 4/20 0.50
MMP2 P08253 4/20 0.50
MMP9 P14780 4/20 0.50
FADS1 O60427 1/20 0.48
EGFR P00533 2/20 0.47
LPAR1 Q92633 1/20 0.46
LPAR2 Q9HBW0 1/20 0.46
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
CA2 P00918 1/20 0.43
NPY5R Q15761 1/20 0.43
CREBBP Q92793 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.42

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
SCHEMBL4646880 0.85 EGFR (0.64) MMP1MMP2MMP9EGFRLPAR1
SCHEMBL4646053 0.83 MMP1 (0.71) HIF1ATRPV1MMP1MMP2MMP9
SCHEMBL4648540 0.83 MMP1 (0.64) HIF1AMMP1MMP2MMP9EGFR
SCHEMBL4645874 0.82 ALDH1A1 (0.57) HIF1AMMP1MMP2MMP9EGFR
SCHEMBL4646853 0.81 MGLL (0.55) HIF1AMMP1MMP2MMP9LPAR1
SCHEMBL11099426 0.81 LPAR2 (0.71) TRPV1FADS1EGFRLPAR1LPAR2
SCHEMBL4646819 0.77 MAPT (0.54) HIF1ATRPV1CA2MEN1KMT2A
SCHEMBL4647915 0.77 SMN1; SMN2 (0.56) HIF1AMMP1MMP2MMP9MEN1
SCHEMBL4647415 0.77 HIF1A (0.47) HIF1AMMP1MMP2MMP9EGFR
SCHEMBL1013517 0.77 CYP1A2 (0.65) FADS1MEN1KMT2A

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