SCHEMBL16046166

SCHEMBL16046166

CC(C)COC(=O)C(=O)c1ccccc1C(=O)OCC(C)C

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.80
TSHR P16473 6/20 0.80
KDM4E B2RXH2 1/20 0.52
MAPT P10636 2/20 0.51
TP53 P04637 2/20 0.51
MEN1 O00255 1/20 0.51
NPY1R P25929 1/20 0.51
NPY2R P49146 1/20 0.51
KMT2A Q03164 1/20 0.51
ATM Q13315 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
NPC1 O15118 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
CYP3A4 P08684 2/20 0.48
CA2 P00918 1/20 0.48
PRSS1 P07477 1/20 0.46
PRSS2 P07478 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
SCHEMBL8144263 0.89 ALDH1A1 (1.00) ALDH1A1TSHRKDM4EMAPTTP53
SCHEMBL29387332 0.89 ALDH1A1 (1.00) ALDH1A1TSHRKDM4EMAPTTP53
SCHEMBL42787 0.89 ALDH1A1 (1.00) ALDH1A1TSHRKDM4EMAPTTP53
SCHEMBL27494884 0.88 ALDH1A1 (0.96) ALDH1A1TSHRKDM4EMAPTTP53
SCHEMBL27345462 0.88 ALDH1A1 (0.96) ALDH1A1TSHRKDM4EMAPTTP53
Ammonia Solution, Strong SCHEMBL28046886 0.88 ALDH1A1 (0.96) ALDH1A1TSHRKDM4EMAPTTP53
SCHEMBL5987707 0.84 ALDH1A1 (0.89) ALDH1A1TSHRKDM4EMAPTTP53
Acetic Acid SCHEMBL28172110 0.84 ALDH1A1 (0.89) ALDH1A1TSHRKDM4EMAPTTP53
Biphenyl SCHEMBL23023808 0.83 ALDH1A1 (0.86) ALDH1A1TSHRKDM4EMAPTTP53
SCHEMBL20511764 0.83 ALDH1A1 (0.86) ALDH1A1TSHRKDM4EMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109180843-B Non-phthalate compounds as electron donors for polyolefin catalysts 美国台塑公司 2022-03-01 CN claimed
EP-2969201-B1 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORP USA (US) 2022-05-04 EP disclosed
CN-109180843-B Non-phthalate compounds as electron donors for polyolefin catalysts 美国台塑公司 2022-03-01 CN disclosed
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
US-9790291-B2 Non-phthalate compounds as electron donors for polyolefin catalysts FORMOSA PLASTICS CORPORATION, USA (US) 2017-10-17 US disclosed
CN-105339085-A Non-phthalate compounds as electron donors for polyolefin catalysts FORMOSA PLASTICS CORP USA 2016-02-17 CN disclosed
EP-2969201-A2 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS Formosa Plastics Corporation, U.S.A. (US) 2016-01-20 EP disclosed
WO-2014160012-A2 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORPORATION, USA (US) 2014-10-02 WO disclosed
US-20140275456-A1 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORPORATION, USA (US) 2014-09-18 US disclosed