SCHEMBL8467685

SCHEMBL8467685

CCOC(=O)CC(=O)C=Cc1ccc(O)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 2/20 0.71
MAOB P27338 2/20 0.71
AKR1B10 O60218 1/20 0.71
PTGS2 P35354 1/20 0.71
GLO1 Q04760 1/20 0.71
CAMK2A Q9UQM7 1/20 0.71
CA12 O43570 2/20 0.69
CA1 P00915 2/20 0.69
CA2 P00918 2/20 0.69
CA7 P43166 2/20 0.69
CA9 Q16790 2/20 0.69
CA14 Q9ULX7 2/20 0.69
BACE1 P56817 12/20 0.61
ABCB1 P08183 1/20 0.57
MAOA P21397 1/20 0.57
TYR P14679 1/20 0.56
GSK3B P49841 1/20 0.54
MMP2 P08253 1/20 0.53
MMP9 P14780 1/20 0.53
MMP13 P45452 1/20 0.53

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
SCHEMBL11547026 0.89 RAB9A (0.57) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL8467852 0.87 AKR1B1 (0.76) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL11460201 0.86 POLB (0.54) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL9297329 0.86 KDM4E (0.53) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL11453495 0.86 ALDH1A1 (0.58) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL11743227 0.86 GSK3B (0.53) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL16865336 0.86 KDM4E (0.53) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL11461106 0.86 GSK3B (0.53) AKR1B1MAOBAKR1B10PTGS2GLO1
SCHEMBL3105202 0.85 HAO1 (0.62) MAOBCA12CA1CA2CA7
SCHEMBL3105207 0.85 HAO1 (0.62) MAOBCA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5951841-A ACIDIC ELECTROPLATING BATHS COMPRISING BRIGHTENERS FOR THE ELECTROLYTIC DEPOSITION OF METALLIC INORGANIC LAYERS ONTO SHAPED ARTICLES BASF AKTIENGESELLSCHAFT (DE) 1999-09-14 US disclosed