SCHEMBL6536636

SCHEMBL6536636

C=C(C)C(=O)OC(C)OC(=O)C=Cc1ccc(O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.64
CA7 P43166 6/20 0.64
CA9 Q16790 6/20 0.64
CA14 Q9ULX7 6/20 0.64
CA1 P00915 5/20 0.64
AKR1B10 O60218 5/20 0.64
AKR1B1 P15121 5/20 0.64
CA2 P00918 4/20 0.64
TYR P14679 3/20 0.53
PYGL P06737 1/20 0.46
F3 P13726 2/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
HSD11B1 P28845 1/20 0.44
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP13 P45452 1/20 0.43
CA4 P22748 3/20 0.43
CA6 P23280 3/20 0.43
CA5A P35218 3/20 0.43

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
SCHEMBL6327959 0.87 TDP1 (0.47) CA12CA7CA9CA14CA1
SCHEMBL6327956 0.87 TDP1 (0.47) CA12CA7CA9CA14CA1
SCHEMBL10079591 0.86 LMNA (0.52) CA12CA7CA9CA14CA1
SCHEMBL7512189 0.84 CA12 (0.69) CA12CA7CA9CA14CA1
SCHEMBL10079581 0.81 CA12 (0.58) CA12CA7CA9CA14CA1
SCHEMBL6536632 0.81 CA12 (0.61) CA12CA7CA9CA14CA1
SCHEMBL23389869 0.81 CA12 (0.60) CA12CA7CA9CA14CA1
SCHEMBL6336593 0.81 KDM4E (0.53) ABCG2
SCHEMBL6336601 0.81 KDM4E (0.53) ABCG2
Isopropyl 3-(4-Hydroxyphenyl)Acrylate SCHEMBL4966894 0.79 CA12 (1.00) CA12CA7CA9CA14CA1

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