SCHEMBL70248

SCHEMBL70248

COC(=O)c1csc(C(=O)OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
CA12 O43570 3/20 0.47
CA7 P43166 3/20 0.47
CA9 Q16790 3/20 0.47
CA14 Q9ULX7 3/20 0.47
KDM4E B2RXH2 5/20 0.45
LMNA P02545 3/20 0.45
XDH P47989 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GAA P10253 2/20 0.45
POLB P06746 1/20 0.45
NFKB1 P19838 1/20 0.45
GFER P55789 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
FUT7 Q11130 1/20 0.45
TSHR P16473 1/20 0.43
CTPS1 P17812 1/20 0.43

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
SCHEMBL8542214 0.90 CTPS1 (0.42) CA1CA2CA12CA7CA9
SCHEMBL7892513 0.90 DAO (0.53) CA1CA2CA12CA7CA9
SCHEMBL9495737 0.88 DAO (0.52) CA1CA2CA12CA7CA9
SCHEMBL15933864 0.88 MAPT (0.48) CA1CA2CA12CA7CA9
SCHEMBL7892516 0.88 GSK3B (0.56) CA1CA2CA12CA7CA9
SCHEMBL21448967 0.86 CA1 (0.42) CA1CA2CA12CA7CA9
SCHEMBL15057163 0.86 CA12 (0.39) CA1CA2CA12CA7CA9
SCHEMBL6925640 0.83 ALDH1A1 (0.40) CA1CA2CA12CA7CA9
SCHEMBL10161073 0.83 CTPS1 (0.39) CA1CA2CA12CA7CA9
SCHEMBL10675048 0.83 CA1 (0.40) CA1CA2CA12CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115044026-A Degradable high-barrier uvioresistant bio-based polyester and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2022-09-13 CN claimed
CN-117624188-A Cyclopentathiofuran carboxamide derivatives as platelet-activating factor receptor antagonists 勃林格殷格翰国际有限公司 2024-03-01 CN disclosed
CN-116745300-A Cyclopentathiofuran carboxamide derivatives as platelet-activating factor receptor antagonists 勃林格殷格翰国际有限公司 2023-09-12 CN disclosed
CN-115044026-A Degradable high-barrier uvioresistant bio-based polyester and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2022-09-13 CN disclosed
CN-114940748-A High-heat-resistance high-barrier anti-ultraviolet bio-based copolyester and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2022-08-26 CN disclosed
CN-110734542-B Novel thiophene diformate copolyester and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2021-06-15 CN disclosed
CN-110734542-A novel thiophene diformate copolyester and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2020-01-31 CN disclosed
CN-109963858-A N3The thieno uracil and application thereof that ring-type replaces 拜耳股份公司 2019-07-02 CN disclosed
CN-109305976-A Compound and its application as ACC inhibitor 南京圣和药业股份有限公司 2019-02-05 CN disclosed
CN-107646035-A Heterocyclyl methyl thieno uracil as adenosine A 2B receptor antagonists 拜耳制药股份公司 2018-01-30 CN disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US disclosed
EP-0267794-B1 PROCESS FOR PREPARING POLYOLEFINS Nippon Petrochemicals Co., Ltd. (JP) 1993-05-05 EP disclosed
EP-0267794-A2 Process for preparing polyolefins Nippon Petrochemicals Co., Ltd. (JP) 1988-05-18 EP disclosed
EP-0052471-B1 PROCESS AND CATALYST FOR POLYMERIZATION OF OLEFINS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1985-09-18 EP disclosed
US-4526941-A Contacting alpha olefin with catalyst comprising organomagnesium compound, titanium compound, nitrogen or sulfur heterocyclic compound, slurry component and organometallic component ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-07-02 US disclosed
US-4525555-A TITANIUM COMPOUND SUPPORTED ON SOLID REACTION PRODUCT OF MAGNESIUM HALIDE, SILOXANES, ORGANIC COMPOUNDS NIPPON OIL COMPANY, LIMITED (JP) 1985-06-25 US disclosed
EP-0052471-A1 Process and catalyst for polymerization of olefins Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-05-26 EP disclosed
US-4330650-A HAVING MAGNESIUM COMPONENTS, TITANIUM COMPONENTS, ORGANOALUMINUM COMPONENTS AND HETEROCYCLIC CARBOXYLIC ESTER ELECTRON DONOR COMPONENTS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-05-18 US disclosed
US-4255280-A ORGANOMAGNESIUM, CHLOROSILANE, TITANIUM, ORGANOMETALLIC AND HETEROCYCLIC ESTER COMPONENTS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1981-03-10 US 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-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 CA1 550/4885CA2 612/4885CA12 1221/4885

“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.