SCHEMBL6709375

SCHEMBL6709375

CC(=O)OCc1cccc(COC(C)=O)c1

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.73
CYP3A4 P08684 1/20 0.56
IDH1 O75874 1/20 0.50
MIF P14174 1/20 0.47
CA2 P00918 1/20 0.45
PRKDC P78527 1/20 0.45
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
STAT1 P42224 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
MAOB P27338 1/20 0.44

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
SCHEMBL801397 0.92 ALDH1A1 (0.63) ALDH1A1CYP3A4IDH1MIFCA2
SCHEMBL7671540 0.92 ALDH1A1 (0.63) ALDH1A1CYP3A4IDH1MIFCA2
SCHEMBL7671543 0.92 ALDH1A1 (0.63) ALDH1A1CYP3A4IDH1MIFCA2
SCHEMBL16154053 0.92 ALDH1A1 (0.63) ALDH1A1CYP3A4IDH1MIFRAB9A
SCHEMBL31160231 0.91 ALDH1A1 (0.61) ALDH1A1CYP3A4IDH1MIFCA2
SCHEMBL27664520 0.91 ALDH1A1 (0.61) ALDH1A1CYP3A4IDH1MIFCA2
SCHEMBL20083591 0.91 ALDH1A1 (0.61) ALDH1A1CYP3A4IDH1MIFRAB9A
SCHEMBL990642 0.91 ALDH1A1 (0.61) ALDH1A1CYP3A4IDH1MIFCA2
SCHEMBL2385123 0.90 ALDH1A1 (0.66) ALDH1A1CYP3A4IDH1MAPK1
SCHEMBL5430015 0.89 ALDH1A1 (0.59) ALDH1A1CYP3A4IDH1MIFCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES Atea Pharmaceuticals, Inc. (US) 2023-10-19 US disclosed
US-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES Atea Pharmaceuticals, Inc. (US) 2023-10-19 US disclosed
US-20040259019-A1 Positive photosensitive composition SUMITOMO CHEMICAL COMPANY, LIMITED 2004-12-23 US disclosed
EP-0311387-B1 AROMATIC AMINE RESINS, THEIR PRODUCTION PROCESS AND THERMOSETTING RESIN COMPOSITIONS MAKING USE OF THE SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-08-11 EP disclosed
EP-0342943-B1 THERMOSETTING RESIN COMPOSITION MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-08-04 EP disclosed
US-5145949-A Production process for making aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1992-09-08 US disclosed
CN-1062544-A The compositions of thermosetting resin that contains arylamino resin MITSUI TOATSU CHEMICALS (JP) 1992-07-08 CN disclosed
CN-1017055-B Process for producing aromatic amine resin MITSUI TOATSU CHEMICALS (JP) 1992-06-17 CN disclosed
US-5106953-A Reacting aromatic amines with bishalogenomethyl derivatives; curing agents or raw materials for polyamides MITSUI TOATSU CHEMICALS, INC. (JP) 1992-04-21 US disclosed
US-5051494-A A bismaleimide and an amino resin MITSUI TOATSU CHEMICALS, INC. (JP) 1991-09-24 US disclosed
US-4959443-A HIGH STRENGTH, REACTION OF ARALKYL ALCOHOL AND AROMATIC AMINE MITSUI TOATSU CHEMICALS, INC. (JP) 1990-09-25 US disclosed
US-4937318-A Aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1990-06-26 US disclosed
EP-0351081-A2 Phenolic resin molding materials MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-01-17 EP disclosed
CN-1037721-A Compositions of thermosetting resin MITSUI TOATSU CHEMICALS (JP) 1989-12-06 CN disclosed
EP-0342943-A1 Thermosetting resin composition MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-11-23 EP disclosed
CN-1032806-A Aromatic amine resin, its preparation method and application in thermosetting resin composition MITSUI TOATSU CHEMICALS (JP) 1989-05-10 CN disclosed
EP-0311387-A2 Aromatic amine resins, their production process and thermosetting resin compositions making use of the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-04-12 EP disclosed
EP-0284385-A2 Aralkylphenolic resin molding material MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-09-28 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-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES NUDT1, PNP, ATIC ALDH1A1 946/4885CYP3A4 1370/4885IDH1 1194/4885

“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.