SCHEMBL7876706

SCHEMBL7876706

CCOC(=O)C(OC(=O)Cl)OC(=O)COc1ccc(Cl)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.56
ALDH1A1 P00352 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MAPT P10636 2/20 0.56
TSHR P16473 2/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.49
ESR1 P03372 1/20 0.46
POLB P06746 1/20 0.46
ESR2 Q92731 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
PKM P14618 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL6887036 0.87 MAPT (0.59) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL6889260 0.87 TDP1 (0.53) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL10463466 0.82 TDP1 (0.55) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL1694924 0.82 TDP1 (0.74) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL29369910 0.82 TDP1 (0.74) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL6887477 0.81 SMN1; SMN2 (0.54) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL10461417 0.80 TDP1 (0.55) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL10464447 0.80 TDP1 (0.55) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL6887033 0.80 SMN1; SMN2 (0.44) TDP1ALDH1A1L3MBTL1MAPTTSHR
SCHEMBL10463437 0.79 TDP1 (0.54) TDP1ALDH1A1L3MBTL1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO disclosed