SCHEMBL7637265

SCHEMBL7637265

CC(C)OC(=O)C(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 7/20 0.52
CES1 P23141 7/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MAPT P10636 3/20 0.52
LMNA P02545 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
XBP1 P17861 1/20 0.52
ATM Q13315 1/20 0.52
PDCD1 Q15116 1/20 0.52
CD274 Q9NZQ7 1/20 0.52
GAA P10253 3/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 3/20 0.49
NPC1 O15118 2/20 0.49
HTT P42858 2/20 0.49
RAB9A P51151 2/20 0.49
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL6666138 0.84 MAPT (0.48) CES2CES1SMN1; SMN2MAPTLMNA
SCHEMBL6666142 0.84 MAPT (0.48) CES2CES1SMN1; SMN2MAPTLMNA
SCHEMBL16194609 0.82 HCAR2 (0.53) CES2CES1SMN1; SMN2MAPTLMNA
SCHEMBL16080776 0.82 MAPT (0.47) CES2CES1SMN1; SMN2MAPTLMNA
SCHEMBL19367967 0.82 CES2 (0.58) CES2CES1SMN1; SMN2LMNANPSR1
SCHEMBL19924994 0.82 SMN1; SMN2 (0.50) CES2CES1SMN1; SMN2MAPTLMNA
SCHEMBL3385018 0.81 CES2 (0.48) CES2CES1SMN1; SMN2MAPTLMNA
SCHEMBL16045774 0.81 TSHR (0.52) CES2CES1SMN1; SMN2MAPTLMNA
SCHEMBL4902023 0.80 TDP1 (0.50) SMN1; SMN2MAPTLMNANPSR1XBP1
SCHEMBL13531616 0.80 CA12 (0.44) CES2CES1SMN1; SMN2LMNAPDCD1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3661901-B1 SYNTHESIS OF GLYCOLS VIA TRANSFER HYDROGENATION OF ALPHA-FUNCTIONAL ESTERS WITH ALCOHOLS EASTMAN CHEM CO (US) 2023-12-06 EP disclosed
CN-110997605-B Synthesis of diols by transfer hydrogenation of alpha-functionalized esters with alcohols 伊士曼化工公司 2023-07-25 CN disclosed
CN-109776465-B Synthesis method of benzodihydrofuran derivative with C2 quaternary carbon center 国网湖南省电力有限公司 2023-06-06 CN disclosed
CN-110234623-B Solution containing dialkylzinc and dialkylzinc partial hydrolysate, and method for producing zinc oxide thin film using same 东曹精细化工株式会社 2023-04-18 CN disclosed
US-11453786-B2 Dialkylzinc- and dialkylzinc partial hydrolysate-containing solution, and method for producing zinc oxide thin film using solution TOSOH FINECHEM CORPORATION (JP) 2022-09-27 US disclosed
EP-3578540-B1 DIALKYLZINC- AND DIALKYLZINC PARTIAL HYDROLYSATE-CONTAINING SOLUTION, AND METHOD FOR PRODUCING ZINC OXIDE THIN FILM USING SOLUTION TOSOH FINECHEM CORP (JP) 2022-05-04 EP disclosed
US-20210009813-A1 DIALKYLZINC- AND DIALKYLZINC PARTIAL HYDROLYSATE-CONTAINING SOLUTION, AND METHOD FOR PRODUCING ZINC OXIDE THIN FILM USING SOLUTION TOSOH FINECHEM CORPORATION (JP) 2021-01-14 US disclosed
EP-3661901-A1 SYNTHESIS OF GLYCOLS VIA TRANSFER HYDROGENATION OF ALPHA-FUNCTIONAL ESTERS WITH ALCOHOLS Eastman Chemical Company (US) 2020-06-10 EP disclosed
CN-110997605-A Synthesis of diols by transfer hydrogenation of α -functionalized esters with alcohols 伊士曼化工公司 2020-04-10 CN disclosed
CN-109776465-A A kind of synthetic method of the coumaran derivative with C2 quaternary carbon center 国网湖南省电力有限公司 2019-05-21 CN disclosed
US-20170266103-A1 MICROCAPSULES CONTAINING A GAS-GENERATING PHOTOLABILE POLYMER AND USES THEREOF FIRMENICH SA (CH) 2017-09-21 US disclosed
US-9738859-B2 Microcapsules containing a gas-generating photolabile ketoacid or ketoester and uses thereof FIRMENICH SA (CH) 2017-08-22 US disclosed
US-20160108346-A1 MICROCAPSULES CONTAINING A GAS-GENERATING PHOTOLABILE KETOACID OR KETOESTER AND USES THEREOF FIRMENICH SA (CH) 2016-04-21 US disclosed
EP-2999457-A1 MICROCAPSULES CONTAINING A GAS-GENERATING PHOTOLABILE KETOACID OR KETOESTER AND USES THEREOF Firmenich SA (CH) 2016-03-30 EP disclosed
CN-105228587-A Containing produce gas to the keto acid of photo-labile or the microcapsule of ketone ester and uses thereof FIRMENICH & CIE 2016-01-06 CN disclosed
WO-2014187833-A1 MICROCAPSULES CONTAINING A GAS-GENERATING PHOTOLABILE KETOACID OR KETOESTER AND USES THEREOF FIRMENICH SA (CH) 2014-11-27 WO disclosed
US-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP disclosed
US-5523459-A OXIDIZING ALPHA-HYDROXYCARBOXYLIC ACID ESTER WITH MOLECULAR OXYGEN IN GASEOUS PHASE IN PRESENCE OF COPPER PHOSPHATE UBE INDUSTRIES, LTD. (JP) 1996-06-04 US disclosed
EP-0673914-A2 Preparation of alpha-keto acid ester UBE INDUSTRIES, LTD. (JP) 1995-09-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170266103-A1 MICROCAPSULES CONTAINING A GAS-GENERATING PHOTOLABILE POLYMER AND USES THEREOF TNF, PHGDH, PHYKPL CES2 1351/4885CES1 543/4885SMN1; SMN2 4466/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.