SCHEMBL5859519

SCHEMBL5859519

COc1ccc(CC(Cc2ccc(OC)cc2)OB(O)OC(Cc2ccc(OC)cc2)Cc2ccc(OC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.53
SLC6A4 P31645 1/20 0.52
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
IDO1 P14902 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
ENPP2 Q13822 1/20 0.44
ACACB O00763 1/20 0.43
POLB P06746 1/20 0.43
CALM1 P0DP23 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
Tetramethylammonium Ion SCHEMBL8395929 0.95 LDHA (0.49) LDHASLC6A4CYP1A2CYP2D6CYP2C19
Tetrylammonium SCHEMBL8397592 0.91 LDHA (0.45) LDHASLC6A4CYP1A2CYP2D6CYP2C19
SCHEMBL5858570 0.89 LDHA (0.46) LDHASLC6A4CYP1A2CYP2D6CYP2C19
Tetrabuthylammonium SCHEMBL8395176 0.85 LDHA (0.41) LDHASLC6A4CYP1A2CYP2D6CYP2C19
SCHEMBL8398914 0.84 USP2 (0.40) LDHASLC6A4CYP1A2CYP2D6CYP2C19
SCHEMBL1262676 0.74 LDHA (0.53) LDHASLC6A4CYP1A2CYP2D6CYP2C19
SCHEMBL5859651 0.74 LDHA (0.62) LDHASLC6A4CYP1A2CYP2D6CYP2C19
SCHEMBL2334749 0.74 SLC6A4 (0.67) LDHASLC6A4CYP1A2CYP2D6CYP2C19
SCHEMBL5859508 0.74 LDHA (0.49) LDHASLC6A4CYP1A2CYP2D6CYP2C19
SCHEMBL5808466 0.73 SLC6A4 (0.50) LDHASLC6A4CYP1A2CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7087353-B2 Non-contact heat fixing toner KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2006-08-08 US disclosed
US-20040142263-A1 Non-contact heat fixing toner KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. 2004-07-22 US disclosed
EP-0661598-B1 Decolorizable toner and a decolorizable toner production process SHOWA DENKO KK (JP) 1998-09-16 EP disclosed
US-5607803-A Decolorizable toner and a decolorizable toner production process SHOWA DENKO K.K. (JP) 1997-03-04 US disclosed
EP-0661598-A1 Decolorizable toner and a decolorizable toner production process SHOWA DENKO KABUSHIKI KAISHA (JP) 1995-07-05 EP disclosed