SCHEMBL758636

SCHEMBL758636

CC(C)(C)OOC(C)(C)C(=O)O.CC(C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALDH1A1 P00352 2/20 0.32
TP53 P04637 1/20 0.32
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL9064573 0.88 TSHR (0.47) TSHRTDP1ALDH1A1TP53HSD17B10
SCHEMBL855979 0.88 TSHR (0.47) TSHRTDP1ALDH1A1HSD17B10MEN1
SCHEMBL8930064 0.80 TSHR (0.47) TSHRTDP1ALDH1A1TP53HSD17B10
SCHEMBL2672443 0.74 ALDH1A1 (0.33) TSHRALDH1A1MEN1CYP1A2CYP3A4
Tert-Butyl Hydroperoxide SCHEMBL27265843 0.72 ALDH1A1 (0.53) TSHRALDH1A1TP53MEN1MAPT
Tert-Butyl Hydroperoxide SCHEMBL5147647 0.72 ALDH1A1 (0.53) TSHRALDH1A1TP53MEN1MAPT
Pivalate SCHEMBL537300 0.72 ALDH1A1 (0.44) TSHRALDH1A1TP53CYP1A2CYP2D6
Pivalate SCHEMBL300936 0.72 TSHR (0.53) TSHRTDP1ALDH1A1TP53HSD17B10
Bicarbonate SCHEMBL27668414 0.71 TSHR (0.61) TSHRTDP1ALDH1A1HSD17B10CYP2D6
SCHEMBL3678597 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0233299-B1 OPTICAL RESIN AND PROCESS FOR PREPARING THE SAME NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-03-13 EP claimed
WO-2026100250-A1 ELECTROCHEMICAL DEVICE AND METHOD FOR PRODUCING SAME 国立大学法人 東京大学 2026-05-15 WO disclosed
EP-4664106-A1 SENSITIZER FOR IMMUNOCHROMATOGRAPHIC MEASUREMENTS TARGETING HEPATITIS VIRUS, SPECIMEN DILUENT FOR IMMUNOCHROMATOGRAPHIC MEASUREMENTS, IMMUNOCHROMATOGRAPHIC MEASUREMENT METHOD, TOOL FOR IMMUNOCHROMATOGRAPHIC MEASUREMENTS AND TEST KIT FOR HEPATITIS VIRUS Kawasaki Gakuen Educational Foundation (JP) 2025-12-17 EP disclosed
EP-4194070-B1 IMPROVED SUPPRESSOR DIONEX CORP (US) 2025-06-04 EP disclosed
CN-119317865-A Soft contact lens with coating 日油株式会社 2025-01-14 CN disclosed
CN-119301512-A Soft contact lens with coating 日油株式会社 2025-01-10 CN disclosed
US-12187012-B2 Laminate, electronic equipment and production method for laminate JNC CORPORATION (JP) 2025-01-07 US disclosed
WO-2024262195-A1 BLOCK COPOLYMER, COMPOSITION, AND ARTICLE USING SAME JNC株式会社 2024-12-26 WO disclosed
CN-117440985-B Coated polyolefin 戴安公司 2024-11-22 CN disclosed
CN-118922458-A Copolymer and contact lens treating liquid 日油株式会社 2024-11-08 CN disclosed
US-5851422-A Polymeric material for liquid crystal/polymer composite film, record display medium, and use thereof DAI NIPPON PRINTING CO., LTD. (JP) 1998-12-22 US disclosed
US-5807942-A ADDITION POLYMERIZABLE MONOMER UNIT IS ATTACHED TO ENZYME, ANTIBODY, ETC. AND RESULTING COMPOUND IS POLYMERIZED THROUGH DOUBLE BOND WITH ANOTHER MODIFIED ENZYME OR ANTIBODY OR WITH A MONOMER SUCH AS METHACRYLAMIDE, USED IN IMMUNOASSAY NOF CORPORATION (JP) 1998-09-15 US disclosed
US-5723558-A MONOMERS OR MEDICAL MATERIAL, BIOSENSORS AND COSMETICS NOF CORPORATION (JP) 1998-03-03 US disclosed
US-5708049-A Colored contact lens and method for producing the same SEIKO EPSON CORPORATION (JP) 1998-01-13 US disclosed
EP-0790252-A1 FUMARIC ACID DERIVATIVE AND POLYMER THEREOF NOF CORPORATION (JP) 1997-08-20 EP disclosed
EP-0788118-A1 Low dielectric polymer and film, substrate and electronic part using the same TDK Corporation (JP) 1997-08-06 EP disclosed
EP-0726474-A2 Colored contact lens and method for producing the same SEIKO EPSON CORPORATION (JP) 1996-08-14 EP disclosed
EP-0501762-B1 Adhesive resin composition SUMITOMO CHEMICAL CO (JP) 1995-12-27 EP disclosed
US-5296552-A Ethylene-maleic anhydride graft SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-03-22 US disclosed
EP-0501762-A1 Adhesive resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-09-02 EP disclosed