SCHEMBL14508779

SCHEMBL14508779

CCCCN(C=O)C(=O)C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA9 Q16790 2/20 0.39
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
EP300 Q09472 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CES2 O00748 2/20 0.32
CES1 P23141 2/20 0.32
TSHR P16473 1/20 0.32
ZDHHC20 Q5W0Z9 2/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
TRPA1 O75762 1/20 0.31
EPHX1 P07099 4/20 0.31
EPHX2 P34913 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
SCHEMBL14242749 0.83 ZDHHC20 (0.44) CA12CA1CA9MMP1MMP2
SCHEMBL13973878 0.82 CA12 (0.35) CA12CA1CA9MMP1MMP2
SCHEMBL16068293 0.80 CA12 (0.40) CA12CA1CA9MMP1MMP2
SCHEMBL7879076 0.78 CA1 (0.39) CA12CA1CA9MMP1MMP2
SCHEMBL11688049 0.78 ALDH1A1 (0.39) CA12CA1CA9MMP1MMP2
Hydrochloric Acid SCHEMBL11688058 0.78 CA12 (0.39) CA12CA1CA9MMP1MMP2
SCHEMBL21983514 0.77 ALDH1A1 (0.40) CA12CA1CA9MMP1MMP2
SCHEMBL13459034 0.76 ADH1C (0.37) CA12CA1CA9ADH1CADH1A
SCHEMBL17089921 0.76 EPHX2 (0.42) CA12CA1CA9MMP1MMP2
SCHEMBL6830441 0.75 EPHX1 (0.43) CA12CA1CA9ALDH1A1EPHX1

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
US-7229738-B2 Silver halide photographic light-sensitive material FUJIFILM CORPORATION (JP) 2007-06-12 US disclosed
US-7172855-B2 Silver halide photographic light-sensitive material and package thereof FUJI PHOTO FILM CO., LTD. (JP) 2007-02-06 US disclosed