SCHEMBL824653

SCHEMBL824653

C=CC(=O)Oc1ccc(CC)cc1C(c1cc(CC)ccc1O)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
THRB P10828 4/20 0.36
THRA P10827 1/20 0.34
PTGER4 P35408 1/20 0.34
GAA P10253 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
POLB P06746 1/20 0.32
ALPL P05186 1/20 0.32
ALPI P09923 1/20 0.32
ALPG P10696 1/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL824508 0.83 ALOX15 (0.48) MEN1KMT2ASMN1; SMN2TDP1CYP3A4
SCHEMBL10085215 0.82 PPARG (0.35) NPC1RAB9AMEN1KMT2APTGER4
SCHEMBL824495 0.71 THRB (0.40) THRBTHRAGAAMAOAMAOB
SCHEMBL824541 0.65 MAPT (0.41) NPC1RAB9AMEN1KMT2ATHRB
SCHEMBL14571904 0.64 GSR (0.44) MEN1KMT2A
SCHEMBL27819211 0.63 TRPA1 (0.52) RAB9AMEN1KMT2ATHRBTHRA
SCHEMBL14173090 0.62 RORC (0.54) MEN1KMT2ATHRBTHRAGAA
SCHEMBL824502 0.62 CYP3A4 (0.37) MEN1KMT2ATHRBTHRAGAA
SCHEMBL9461082 0.62 TRPA1 (0.55) RAB9AMEN1KMT2ATHRBTHRA
SCHEMBL4595847 0.62 THRB (0.74) NPC1RAB9AMEN1KMT2ATHRB

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