SCHEMBL13599604

SCHEMBL13599604

CCCCCCCCCCCCCC(Cc1cc(C)c(O)c(C(C)(C)C)c1)(C(=O)OC1CC(C)(C)NC(C)(C)C1)C(=O)OC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.33
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
ESR1 P03372 1/20 0.31
CNR1 P21554 3/20 0.31
CNR2 P34972 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL11498603 1.00 GAA (0.33) GAAPKMHTTESR1CNR1
SCHEMBL12897904 0.97 GAA (0.33) GAAPKMHTTSMN1; SMN2MEN1
SCHEMBL12897908 0.94 KMT2A (0.35) GAAPKMHTTCNR1CNR2
SCHEMBL14125224 0.93 GAA (0.31) GAAPKMHTT
SCHEMBL31363 0.91 ALDH1A1 (0.36) GAAPKMHTTMEN1USP2
SCHEMBL13599637 0.89 GAA (0.36) GAAPKMHTTSMN1; SMN2MEN1
SCHEMBL12264034 0.89 GAA (0.37) GAAHTTESR1SMN1; SMN2
SCHEMBL14125236 0.87 GAA (0.33) GAAPKMHTTMEN1USP2
SCHEMBL24107365 0.86 GAA (0.33) GAAPKMHTTMEN1USP2
SCHEMBL13599613 0.86 GAA (0.34) GAAPKMHTTSMN1; SMN2MEN1

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-20120298007-A1 PROCESS FOR PRODUCING CELLULOSE ESTER FILM, CELLULOSE ESTER FILM, POLARIZATION PLATE AND DISPLAY UNIT KONICA MINOLTA OPTO, INC. (JP) 2012-11-29 US disclosed
US-20120298007-A1 PROCESS FOR PRODUCING CELLULOSE ESTER FILM, CELLULOSE ESTER FILM, POLARIZATION PLATE AND DISPLAY UNIT KONICA MINOLTA OPTO, INC. (JP) 2012-11-29 US disclosed
US-20090306361-A1 PROCESS FOR PRODUCING CELLULOSE ESTER FILM, CELLULOSE ESTER FILM, POLARIZATION PLATE AND DISPLAY UNIT KONICA MINOLTA OPTO, INC. (JP) 2009-12-10 US disclosed
US-20090306361-A1 PROCESS FOR PRODUCING CELLULOSE ESTER FILM, CELLULOSE ESTER FILM, POLARIZATION PLATE AND DISPLAY UNIT KONICA MINOLTA OPTO, INC. (JP) 2009-12-10 US disclosed