SCHEMBL678671

SCHEMBL678671

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.39
DGAT1 O75907 1/20 0.35
CA2 P00918 2/20 0.33
CA12 O43570 2/20 0.33
CA14 Q9ULX7 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
EPHX2 P34913 1/20 0.32
CA1 P00915 2/20 0.32
CA7 P43166 2/20 0.32
ALDH1A1 P00352 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
TET2 Q6N021 1/20 0.30
EPHX1 P07099 1/20 0.30

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
Fluoride SCHEMBL3612510 0.98 CYP2D6 (0.38) CYP2D6DGAT1CA2CA12CA14
SCHEMBL7223189 0.89 CA2 (0.40) CYP2D6DGAT1CA2CA12CA14
SCHEMBL3940721 0.89 ALDH1A1 (0.39) CYP2D6DGAT1CA2CA12CA14
SCHEMBL12128758 0.84 GAA (0.50) ALDH1A1GAAL3MBTL1
SCHEMBL8641614 0.83 CYP2D6 (0.31) CYP2D6DGAT1GAA
SCHEMBL4838871 0.83 TET2 (0.42) CYP2D6DGAT1CA2CA12CA14
SCHEMBL28320509 0.83 GAA (0.36) CYP2D6DGAT1CA2CA12CA14
SCHEMBL7085941 0.83 ALOX15 (0.39) CYP2D6DGAT1CA2CA12CA14
SCHEMBL22615873 0.81 CYP2D6 (0.40) CYP2D6CA2CA1CA7
SCHEMBL23588117 0.81 MAOA (0.38) CYP2D6DGAT1CA2TDP1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114316250-B Polyether secondary amine ester resin and preparation method thereof 深圳飞扬骏研新材料股份有限公司 2024-06-18 CN claimed
CN-115895558-A Polyurea adhesive and preparation method and application thereof 深圳飞扬骏研新材料股份有限公司 2023-04-04 CN claimed
CN-114315621-A Aliphatic secondary amino ester resin and preparation method thereof 深圳飞扬骏研新材料股份有限公司 2022-04-12 CN claimed
CN-114316250-A Polyether family secondary amine ester resin and preparation method thereof 深圳飞扬骏研新材料股份有限公司 2022-04-12 CN claimed
US-20020164548-A1 Wet etch compatible deep UV photoresist compositions ARCH SPECIALTY CHEMICALS, INC. 2002-11-07 US claimed
US-5883152-A HARD CONTACT LENS CONSISTING OF A COPOLYMER OF CARBOXYLIC ACID ESTER MONOMER, TRIS(TRIMETHYLSILOXY)SILYLPROPYL(METH)ACRYLATE, AND COPOLYMERIZABLE MONOMER NIPPON OIL AND FATS CO., LTD. (JP) 1999-03-16 US claimed
JP-3292332-A None JP disclosed
US-20250205188-A1 TREATMENT OR PREVENTION OF RESPIRATORY DISEASES CHARACTERISED BY, OR INVOLVING, LUNG FIBROSIS IMPERIAL COLLEGE INNOVATIONS LTD (GB) 2025-06-26 US disclosed
CN-114315621-B Aliphatic secondary amino ester resin and preparation method thereof 深圳飞扬骏研新材料股份有限公司 2024-07-02 CN disclosed
CN-114316250-B Polyether secondary amine ester resin and preparation method thereof 深圳飞扬骏研新材料股份有限公司 2024-06-18 CN disclosed
WO-2023175336-A1 ITACONATE ANALOGUES FOR TREATMENT OR PREVENTION OF RESPIRATORY DISEASES CHARACTERISED BY, OR INVOLVING, LUNG FIBROSIS IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2023-09-21 WO disclosed
WO-2023175336-A1 ITACONATE ANALOGUES FOR TREATMENT OR PREVENTION OF RESPIRATORY DISEASES CHARACTERISED BY, OR INVOLVING, LUNG FIBROSIS IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2023-09-21 WO disclosed
CN-113462443-B Diesel antiwear agent composition, preparation method thereof and diesel oil composition 中国石油化工股份有限公司 2023-07-14 CN disclosed
EP-0425831-A2 Contact lens NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-05-08 EP disclosed
US-4975471-A Photo-curable epoxy resin type composition KABUSHIKI KAISHA TOSHIBA (JP) 1990-12-04 US disclosed
US-4743667-A ACRYLATED SILOXXANES, OXYGEN PERMEABLE NIPPON CONTACT LENS, INC. (JP) 1988-05-10 US disclosed
EP-0123842-B1 PHOTO-CURABLE EPOXY RESIN TYPE COMPOSITION KABUSHIKI KAISHA TOSHIBA (JP) 1987-08-19 EP disclosed
EP-0195846-A2 Photo-curable epoxy resin type composition and curing process KABUSHIKI KAISHA TOSHIBA (JP) 1986-10-01 EP disclosed
EP-0123842-A1 Photo-curable epoxy resin type composition KABUSHIKI KAISHA TOSHIBA (JP) 1984-11-07 EP disclosed
EP-0114258-A1 Resin encapsulation type photo-semiconductor devices KABUSHIKI KAISHA TOSHIBA (JP) 1984-08-01 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-20250205188-A1 TREATMENT OR PREVENTION OF RESPIRATORY DISEASES CHARACTERISED BY, OR INVOLVING, LUNG FIBROSIS SDHA, SDHB, FH CYP2D6 1184/4885DGAT1 832/4885CA2 494/4885

“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.