SCHEMBL5282308

SCHEMBL5282308

C=C(C(N)=O)C(CCC)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TDP1 Q9NUW8 2/20 0.35
CHRM1 P11229 1/20 0.34
AKR1A1 P14550 1/20 0.34
CHRM3 P20309 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 1/20 0.34
DRD3 P35462 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
CYP3A4 P08684 2/20 0.33
TSHR P16473 2/20 0.33
NFKB1 P19838 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
GRIK1 P39086 1/20 0.31
SLC1A3 P43003 1/20 0.31

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
SCHEMBL9074793 0.91 TDP1 (0.38) CA1CA2TDP1CHRM1AKR1A1
SCHEMBL5288751 0.88 CA2 (0.48) CA1CA2TDP1SLC1A3SLC1A2
SCHEMBL1378930 0.81 CA1 (0.46) CA1CA2TDP1CHRM1AKR1A1
SCHEMBL28875767 0.77 TDP1 (0.48) CA1CA2TDP1CHRM1AKR1A1
SCHEMBL7647512 0.77 CHRM1 (0.52) CA1CA2TDP1CHRM1AKR1A1
SCHEMBL788117 0.77 CHRM1 (0.52) CA1CA2TDP1CHRM1AKR1A1
SCHEMBL7624643 0.77 CHRM1 (0.52) CA1CA2TDP1CHRM1AKR1A1
SCHEMBL17672253 0.77 TDP1 (0.41) CA1CA2TDP1
SCHEMBL3230815 0.76 HSD17B10 (0.39) CA1CA2TDP1CHRM1AKR1A1
SCHEMBL1883516 0.76 SLC1A2 (0.41) CA1CA2TDP1CHRM1AKR1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1281516-B1 Planographic printing plate precursor FUJIFILM CORP (JP) 2007-12-19 EP disclosed
US-6951171-B2 Using graft polymer on etched or anodized aluminum substrate FUJI PHOTO FILM CO., LTD. (JP) 2005-10-04 US disclosed
US-20030129520-A1 Using graft polymer on etched or anodized aluminum substrate FUJIFILM CORPORATION (JP) 2003-07-10 US disclosed
EP-1281516-A2 Planographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2003-02-05 EP disclosed