SCHEMBL824495

SCHEMBL824495

C=CC(=O)Oc1ccc(CCO)cc1C(C)c1cc(CCO)ccc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.40
ALOX5 P09917 3/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
BACE1 P56817 1/20 0.38
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
THRA P10827 2/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
PTGS1 P23219 2/20 0.34
CES2 O00748 1/20 0.34
ADRB2 P07550 1/20 0.33
ADRA2A P08913 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA2C P18825 1/20 0.33
DRD1 P21728 1/20 0.33
ADRA1A P35348 1/20 0.33

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
SCHEMBL843980 0.81 ADRB2 (0.38) THRBALOX5ALDH1A1KDM4EGAA
SCHEMBL824536 0.80 ALOX15 (0.47) ALOX5KDM4ECYP3A4LTA4H
SCHEMBL824541 0.79 MAPT (0.41) THRBGAAMAPTADRA2AADRA1A
SCHEMBL824502 0.76 CYP3A4 (0.37) THRBGAAMAPTMAOAMAOB
SCHEMBL824477 0.74 RORC (0.41) THRBALDH1A1KDM4EGAATHRA
SCHEMBL21030277 0.71 THRB (0.44) THRBKDM4EGAAMAPTTHRA
SCHEMBL28789358 0.71 THRB (0.42) THRBALOX5GAATHRACYP3A4
SCHEMBL824653 0.71 NPC1 (0.37) THRBKDM4EGAAMAOAMAOB
SCHEMBL2791329 0.71 THRB (0.41) THRBALOX5BACE1THRACYP3A4
SCHEMBL342562 0.68 THRB (0.72) THRBCYP4F2CYP4A11PTGS2

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
US-8142864-B2 Cellulose ester pellets, cellulose ester film, manufacturing method of cellulose ester film, polarizing plate, and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2012-03-27 US disclosed
US-8142864-B2 Cellulose ester pellets, cellulose ester film, manufacturing method of cellulose ester film, polarizing plate, and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2012-03-27 US disclosed
US-20100047480-A1 CELLULOSE ESTER PELLETS, CELLULOSE ESTER FILM, MANUFACTURING METHOD OF CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY C/O KONICA MINOLTA OPTO, INC. (JP) 2010-02-25 US disclosed
US-20100047480-A1 CELLULOSE ESTER PELLETS, CELLULOSE ESTER FILM, MANUFACTURING METHOD OF CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY C/O KONICA MINOLTA OPTO, INC. (JP) 2010-02-25 US disclosed