SCHEMBL6536632

SCHEMBL6536632

C=C(C)COC(C)OC(=O)/C=C/c1ccc(O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.61
CA7 P43166 6/20 0.61
CA9 Q16790 6/20 0.61
CA14 Q9ULX7 6/20 0.61
AKR1B10 O60218 6/20 0.61
AKR1B1 P15121 6/20 0.61
CA1 P00915 5/20 0.61
CA2 P00918 4/20 0.61
TYR P14679 3/20 0.50
PYGL P06737 1/20 0.47
CA4 P22748 3/20 0.44
CA6 P23280 3/20 0.44
CA5A P35218 3/20 0.44
CA5B Q9Y2D0 3/20 0.44
MET P08581 1/20 0.44
MAOB P27338 3/20 0.43
PTGS2 P35354 1/20 0.43
GLO1 Q04760 1/20 0.43
CAMK2A Q9UQM7 1/20 0.43
MMP2 P08253 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
SCHEMBL11666334 0.88 KMT2A (0.46) CA12CA7CA9CA14AKR1B10
SCHEMBL6536636 0.81 CA12 (0.64) CA12CA7CA9CA14AKR1B10
SCHEMBL1673241 0.80 HCAR2 (0.39) HCAR2
SCHEMBL7512189 0.79 CA12 (0.69) CA12CA7CA9CA14AKR1B10
Isopropyl 3-(4-Hydroxyphenyl)Acrylate SCHEMBL4966894 0.77 CA12 (1.00) CA12CA7CA9CA14AKR1B10
Isopropyl 3-(4-Hydroxyphenyl)Acrylate SCHEMBL4966886 0.77 CA12 (1.00) CA12CA7CA9CA14AKR1B10
SCHEMBL6389143 0.75 CA12 (0.62) CA12CA7CA9CA14AKR1B10
SCHEMBL10295390 0.75 CA12 (0.71) CA12CA7CA9CA14AKR1B10
SCHEMBL10079581 0.74 CA12 (0.58) CA12CA7CA9CA14AKR1B10
SCHEMBL6657474 0.74 HCAR2 (0.52) HCAR2

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-6713523-B2 DECOLORING DYES FUJI PHOTO FILM CO., LTD. (JP) 2004-03-30 US disclosed
US-20020168494-A1 Photopolymerizable composition and photosensitive thermal recording material FUJI PHOTO FILM CO., LTD. 2002-11-14 US disclosed