SCHEMBL454793

SCHEMBL454793

CCOC(=O)c1sc(-c2ccc(O)c(C=O)c2)nc1C

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 9/20 0.59
DBF4 Q9UBU7 9/20 0.59
TRPM8 Q7Z2W7 7/20 0.53
MAPT P10636 3/20 0.51
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HSP90AA1 P07900 1/20 0.48
CRHBP P24387 1/20 0.48
CRHR2 Q13324 1/20 0.48

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
SCHEMBL29627451 1.00 CDC7 (0.59) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL15947327 0.86 CDC7 (0.54) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL12186978 0.85 CDC7 (0.64) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL31534636 0.84 CDC7 (0.57) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL27838195 0.84 CDC7 (0.57) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL28381444 0.84 CDC7 (0.57) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL2009745 0.84 RAB9A (0.59) KDM4EALDH1A1KMT2A
SCHEMBL19523297 0.83 CDC7 (0.62) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL455876 0.83 CDC7 (0.62) CDC7DBF4TRPM8MAPTKDM4E
SCHEMBL8867093 0.83 CDC7 (0.62) CDC7DBF4TRPM8MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924211-A Preparation method of febuxostat 哈药集团技术中心 2024-04-26 CN claimed
CN-117069675-A Preparation method of febuxostat 河北冀衡药业股份有限公司 2023-11-17 CN claimed
CN-110229117-B Novel preparation method of febuxostat 福安药业集团重庆博圣制药有限公司 2023-04-18 CN claimed
CN-115772137-A Preparation method of febuxostat 济宁晟泰药业有限公司 2023-03-10 CN claimed
CN-109320474-B Preparation method of febuxostat 昆明源瑞制药有限公司 2021-06-29 CN claimed
CN-112961119-A Preparation method of febuxostat impurity 廊坊师范学院 2021-06-15 CN claimed
CN-111110854-A Composition comprising a histamine release-promoting substance and an inhibitory compound 黄泳华 2020-05-08 CN claimed
CN-111039891-A Method for synthesizing febuxostat and intermediate thereof 杭州朱养心药业有限公司 2020-04-21 CN claimed
US-20140112992-A1 PROCESS FOR FEBUXOSTAT HETERO RESEARCH FOUNDATION (IN) 2014-04-24 US claimed
EP-2718272-A2 PROCESS FOR FEBUXOSTAT Hetero Research Foundation (IN) 2014-04-16 EP claimed
WO-2012168948-A2 PROCESS FOR FEBUXOSTAT HETERO RESEARCH FOUNDATION (IN) 2012-12-13 WO claimed
WO-2012131590-A1 AN IMPROVED PROCESS FOR PREPARATION OF FEBUXOSTAT AND ITS POLYMORPHIC CRYSTALLINE FORM C THEREOF SANDOZ AG (CH) 2012-10-04 WO claimed
WO-2011141933-A2 PROCESS FOR PREPARATION OF 2-[3-CYANO-4-(2-METHYLPROPOXY)PHENYL]-4-METHYLTHIAZOLE-5-CARBOXYLIC ACID AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS MSN LABORATORIES LIMITED (IN) 2011-11-17 WO claimed
CN-111072591-B Febuxostat and intermediates and synthesis thereof 杭州朱养心药业有限公司 2025-03-28 CN disclosed
CN-111039891-B Method for synthesizing febuxostat and intermediate thereof 杭州朱养心药业有限公司 2025-03-28 CN disclosed
CN-110824067-B Method for detecting genotoxic impurities in febuxostat 天津药物研究院有限公司 2024-12-27 CN disclosed
WO-2011141933-A2 PROCESS FOR PREPARATION OF 2-[3-CYANO-4-(2-METHYLPROPOXY)PHENYL]-4-METHYLTHIAZOLE-5-CARBOXYLIC ACID AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS MSN LABORATORIES LIMITED (IN) 2011-11-17 WO disclosed
WO-2011066803-A1 PREPARATION METHOD OF INTERMEDIATE OF FEBUXOSTAT 重庆医药工业研究院有限责任公司 (CN) 2011-06-09 WO disclosed
WO-2011031409-A1 PROCESSES FOR PREPARING FEBUXOSTAT TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-03-17 WO disclosed
WO-2011031409-A1 PROCESSES FOR PREPARING FEBUXOSTAT TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-03-17 WO 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-20140112992-A1 PROCESS FOR FEBUXOSTAT FIP1L1, FH, FIBP CDC7 4490/4885DBF4 2831/4885TRPM8 4125/4885

“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.