SCHEMBL274512

SCHEMBL274512

CC(C)C(OCCc1ccc(O)cc1)OCCc1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.48
ESR2 Q92731 2/20 0.48
CA2 P00918 1/20 0.43
CALM1 P0DP23 1/20 0.43
TAAR1 Q96RJ0 4/20 0.42
SLC6A2 P23975 4/20 0.42
TMEM97 Q5BJF2 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
ALDH1A1 P00352 3/20 0.42
ADRA2A P08913 3/20 0.42
KDM4E B2RXH2 2/20 0.42
HTR1A P08908 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTR3A P46098 1/20 0.42
BACE1 P56817 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41

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
SCHEMBL9725762 0.84 ESR1 (0.52) ESR1ESR2CA2CALM1TAAR1
SCHEMBL10448894 0.79 ESR1 (0.46) ESR1ESR2CA2CALM1TAAR1
SCHEMBL9253919 0.77 ESR1 (0.46) ESR1ESR2CA2CALM1TAAR1
SCHEMBL1835544 0.75 SIGMAR1 (0.54) ESR1ESR2TAAR1SLC6A2SIGMAR1
SCHEMBL31651134 0.73 ESR1 (0.48) ESR1ESR2CA2CALM1TAAR1
SCHEMBL9260224 0.73 ESR1 (0.46) ESR1ESR2CA2CALM1TAAR1
SCHEMBL303516 0.73 ESR1 (0.59) ESR1ESR2CA2CALM1TAAR1
SCHEMBL8389404 0.72 ESR1 (0.65) ESR1ESR2CA2CALM1TAAR1
SCHEMBL8914097 0.72 ESR1 (0.47) ESR1ESR2CA2CALM1TAAR1
SCHEMBL29183695 0.72 ESR1 (0.46) ESR1ESR2CA2CALM1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1894957-B1 Flexographic printing plate precursor of laser engraving type FUJIFILM CORP (JP) 2012-10-17 EP disclosed
US-8133654-B2 Laser-decomposable resin composition and laser-decomposable pattern-forming material and flexographic printing plate precursor of laser engraving type using the same FUJIFILM CORPORATION (JP) 2012-03-13 US disclosed
US-8133654-B2 Laser-decomposable resin composition and laser-decomposable pattern-forming material and flexographic printing plate precursor of laser engraving type using the same FUJIFILM CORPORATION (JP) 2012-03-13 US disclosed
US-7531291-B2 heat-decomposable cured polyurethane having an aromatic group is directly connected to a urethane bond; high sensitivity to easily form a pattern FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed
US-7531291-B2 heat-decomposable cured polyurethane having an aromatic group is directly connected to a urethane bond; high sensitivity to easily form a pattern FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed
US-20090099320-A1 LASER-DECOMPOSABLE RESIN COMPOSITION AND LASER-DECOMPOSABLE PATTERN-FORMING MATERIAL AND FLEXOGRAPHIC PRINTING PLATE PRECURSOR OF LASER ENGRAVING TYPE USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-16 US disclosed
US-20090099320-A1 LASER-DECOMPOSABLE RESIN COMPOSITION AND LASER-DECOMPOSABLE PATTERN-FORMING MATERIAL AND FLEXOGRAPHIC PRINTING PLATE PRECURSOR OF LASER ENGRAVING TYPE USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-16 US disclosed
US-20080057437-A1 heat-decomposable cured polyurethane having an aromatic group is directly connected to a urethane bond; high sensitivity to easily form a pattern FUJIFILM CORPORATION (JP) 2008-03-06 US disclosed
US-20080057437-A1 heat-decomposable cured polyurethane having an aromatic group is directly connected to a urethane bond; high sensitivity to easily form a pattern FUJIFILM CORPORATION (JP) 2008-03-06 US disclosed