SCHEMBL5861545

SCHEMBL5861545

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
ENPP2 Q13822 1/20 0.44
CALM1 P0DP23 1/20 0.42
AGXT P21549 2/20 0.41
LTA4H P09960 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CA12 O43570 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
PKM P14618 1/20 0.41
LDHA P00338 1/20 0.41
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40

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 SCHEMBL8397673 0.95 IDO1 (0.40) IDO1CA1CA2ENPP2CALM1
Tetrylammonium SCHEMBL8398755 0.91 IDO1 (0.37) IDO1CA1CA2ENPP2CALM1
Tetrabuthylammonium SCHEMBL8398653 0.85 CASR (0.39) CALM1ALDH1A1TSHRALOX12SMN1; SMN2
SCHEMBL8397590 0.84 USP2 (0.40) TSHR
SCHEMBL26695481 0.74 IDO1 (0.54) IDO1CA1CA2CALM1AGXT
SCHEMBL25374914 0.74 LDHA (0.42) LDHASLC6A4
SCHEMBL16424752 0.73 IDO1 (0.56) IDO1CA1CA2CALM1AGXT
SCHEMBL809115 0.72 IDO1 (0.50) IDO1CA1CA2CALM1AGXT
SCHEMBL11132376 0.72 IDO1 (0.50) IDO1CA1CA2CALM1AGXT
SCHEMBL73472 0.71 IDO1 (0.54) IDO1CA1CA2CALM1AGXT

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 8 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-0613058-B1 Light-decolorizable recording material SHOWA DENKO KK (JP) 1999-06-02 EP disclosed
US-5846682-A Light decolorizable recording material, ink and toner SHOWA DENKO K.K. (JP) 1998-12-08 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
EP-0613058-A1 Light-decolorizable recording material SHOWA DENKO KABUSHIKI KAISHA (JP) 1994-08-31 EP disclosed