SCHEMBL6533551

SCHEMBL6533551

CC(O)COC(C)COC(C)CO.CCCCCOCCCCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
USP2 O75604 1/20 0.50
HTT P42858 2/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
THRB P10828 1/20 0.43
KMT2A Q03164 1/20 0.43
SPHK1 Q9NYA1 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 1/20 0.38
PLA2G2C Q5R387 1/20 0.37
LPAR5 Q9H1C0 1/20 0.36
LPAR1 Q92633 4/20 0.36
LPAR3 Q9UBY5 4/20 0.36
LPAR2 Q9HBW0 1/20 0.36

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
SCHEMBL2978662 0.98 TDP1 (0.54) TDP1USP2HTTMAPTMEN1
SCHEMBL10991776 0.98 TDP1 (0.54) TDP1USP2HTTMAPTMEN1
SCHEMBL4620864 0.98 TDP1 (0.54) TDP1USP2HTTMAPTMEN1
SCHEMBL56119 0.95 TDP1 (0.58) TDP1USP2HTTMAPTMEN1
SCHEMBL8642763 0.93 USP2 (0.54) TDP1USP2HTTMAPTMEN1
SCHEMBL4317251 0.92 TDP1 (0.64) TDP1USP2HTTMAPTMEN1
SCHEMBL5926095 0.92 HTT (0.55) TDP1USP2HTTMAPTMEN1
SCHEMBL28753006 0.92 TDP1 (0.53) TDP1USP2HTTMAPTSPHK1
SCHEMBL5388064 0.91 TDP1 (0.56) TDP1USP2HTTMAPTMEN1
SCHEMBL28417594 0.90 TDP1 (0.61) TDP1USP2HTTMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1664707-B Scouring agent and flushing fluid for the planography DAICEL CHEM 2011-09-14 CN claimed
CN-1670628-B Resist composition DAICEL CHEM 2011-02-09 CN claimed
CN-1670628-A Resist composition DAICEL CHEM (JP) 2005-09-21 CN claimed
CN-1664707-A Scouring agent and flushing fluid for the planography DAICEL CHEM (JP) 2005-09-07 CN claimed
CN-1664707-B Scouring agent and flushing fluid for the planography DAICEL CHEM 2011-09-14 CN disclosed
CN-1670628-B Resist composition DAICEL CHEM 2011-02-09 CN disclosed
CN-1670628-B Resist composition DAICEL CHEM 2011-02-09 CN disclosed
JP-2005301210-A RESIST COMPOSITION DAICEL CHEM IND LTD 2005-10-27 JP disclosed
CN-1670628-A Resist composition DAICEL CHEM (JP) 2005-09-21 CN disclosed
CN-1670628-A Resist composition DAICEL CHEM (JP) 2005-09-21 CN disclosed
CN-1664707-A Scouring agent and flushing fluid for the planography DAICEL CHEM (JP) 2005-09-07 CN disclosed