SCHEMBL6413053

SCHEMBL6413053

CCC=Cc1cccc2c1C(=O)OC2=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
ALOX15 P16050 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TYMS P04818 3/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
TRPA1 O75762 1/20 0.36
SLC37A4 O43826 1/20 0.32

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
SCHEMBL6413047 1.00 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1ALOX15TDP1
SCHEMBL28732463 0.83 ALOX15 (0.38) ALDH1A1TSHRMAPK1ALOX15TDP1
SCHEMBL8921083 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1
SCHEMBL8922327 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1
SCHEMBL31415615 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1
SCHEMBL3751429 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1
SCHEMBL4603785 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1
SCHEMBL8918807 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1
SCHEMBL3751427 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1
SCHEMBL475815 0.82 CYSLTR2 (0.41) ALDH1A1TSHRALOX15KDM4ETRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202122-B1 Method for producing polyester resin particle dispersion material, method for producing polyester resin particles, and method for producing electrophotographic spherical toner DAINIPPON INK & CHEMICALS (JP) 2005-06-15 EP disclosed
US-6821703-B2 NEUTRALIZING THE CARBOXYL GROUPS OF A DISPERSION OF A POLYESTER RESIN MELT HAVING END GROUPS FORMED BY REACTING WITH AN ALKYL OR ALKENYL ANHYDRIDE, IN A HEATED AQUEOUS MEDIUM, COOLING THE DISPERSED RESIN MELT DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-11-23 US disclosed
US-20020076639-A1 Method for producing polyester resin particle dispersion material, method for producing polyester resin particles, and method for producing electrophotographic spherical toner DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-06-20 US disclosed
EP-1202122-A1 Method for producing polyester resin particle dispersion material, method for producing polyester resin particles, and method for producing electrophotographic spherical toner DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-05-02 EP disclosed