SCHEMBL28052900

SCHEMBL28052900

CCOS(=O)(=O)CCOC(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.60
TDP1 Q9NUW8 2/20 0.54
SMN1; SMN2 Q16637 5/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPK1 P28482 2/20 0.45
HIF1A Q16665 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
MEN1 O00255 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAOA P21397 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL6115054 0.87 TDP1 (0.58) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL27785317 0.80 TDP1 (0.66) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL2608651 0.78 TDP1 (0.63) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL27638550 0.78 HSD11B1 (0.56) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL15662524 0.77 TDP1 (0.46) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL3456473 0.77 TDP1 (0.53) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL27256658 0.77 TDP1 (0.61) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL27510780 0.77 TDP1 (0.61) LMNATDP1SMN1; SMN2NPC1RAB9A
Ether SCHEMBL2201004 0.76 LMNA (0.72) LMNATDP1SMN1; SMN2NPC1RAB9A
SCHEMBL6115242 0.76 TDP1 (0.51) LMNATDP1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109180843-A The non-phthalic acid ester compound as electron donor for polyolefin catalyst 美国台塑公司 2019-01-11 CN disclosed
CN-105339085-B Non-phthalate compounds as electron donors for polyolefin catalysts 美国台塑公司 2018-06-26 CN disclosed
CN-105339085-A Non-phthalate compounds as electron donors for polyolefin catalysts FORMOSA PLASTICS CORP USA 2016-02-17 CN disclosed