SCHEMBL13599657

SCHEMBL13599657

CCCCC(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)(C(=O)NC1CC(C)(C)NC(C)(C)C1)C(=O)OC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 2/20 0.35
POLB P06746 2/20 0.35
KMT2A Q03164 5/20 0.35
MEN1 O00255 4/20 0.35
MAPT P10636 2/20 0.35
RECQL P46063 1/20 0.35
ATM Q13315 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
GAA P10253 3/20 0.32
HMGCR P04035 1/20 0.32
TP53 P04637 1/20 0.32
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 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
SCHEMBL12897917 0.91 POLB (0.40) EZH2POLBKMT2AMEN1MAPT
SCHEMBL31363 0.91 ALDH1A1 (0.36) KMT2AMEN1MAPTRECQLATM
SCHEMBL12897908 0.88 KMT2A (0.35) KMT2AMEN1MAPTATMPKM
SCHEMBL14125236 0.86 GAA (0.33) KMT2AMEN1MAPTATMPKM
SCHEMBL14125247 0.86 POLB (0.36) EZH2POLBKMT2AMEN1MAPT
SCHEMBL24107365 0.86 GAA (0.33) KMT2AMEN1MAPTATMPKM
SCHEMBL12897904 0.85 GAA (0.33) KMT2AMEN1MAPTATMPKM
SCHEMBL5819786 0.85 KMT2A (0.33) KMT2AMEN1MAPTATMPKM
SCHEMBL5075832 0.84 ALDH1A1 (0.41) EZH2KMT2AMEN1MAPTATM
SCHEMBL14093368 0.83 GAA (0.32) GAAHMGCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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