SCHEMBL791556

SCHEMBL791556

COCCNC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
MEN1 O00255 1/20 0.53
GAA P10253 1/20 0.53
KMT2A Q03164 1/20 0.53
CA12 O43570 7/20 0.50
CA1 P00915 7/20 0.50
CA2 P00918 7/20 0.50
CA9 Q16790 7/20 0.50
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
IDO1 P14902 1/20 0.47
EPHX1 P07099 1/20 0.46
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL21106180 0.89 TDP1 (0.50) TDP1MEN1GAAKMT2ACA12
SCHEMBL21534023 0.89 TDP1 (0.50) TDP1MEN1GAAKMT2ACA12
SCHEMBL25985788 0.89 TDP1 (0.50) TDP1MEN1GAAKMT2ACA12
SCHEMBL15691138 0.89 TDP1 (0.50) TDP1MEN1GAAKMT2ACA12
SCHEMBL5675016 0.89 TDP1 (0.50) TDP1MEN1GAAKMT2ACA12
SCHEMBL25985952 0.89 TDP1 (0.50) TDP1MEN1GAAKMT2ACA12
SCHEMBL13699507 0.89 TDP1 (0.50) TDP1MEN1GAAKMT2ACA12
SCHEMBL13526277 0.88 TDP1 (0.62) TDP1MEN1GAAKMT2ACA12
SCHEMBL31312814 0.87 TDP1 (0.45) TDP1MEN1GAAKMT2ACA12
SCHEMBL1950985 0.87 TDP1 (0.45) TDP1MEN1GAAKMT2ACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113999125-B Preparation method of 2-methoxyethylamine 苏州昊帆生物股份有限公司 2024-03-05 CN claimed
CN-111295386-B Thienopyridine derivatives and pharmaceutical compositions containing the same 伟迈可生物有限公司 2022-09-06 CN claimed
CN-113999125-A Preparation method of 2-methyl ethylamine 苏州昊帆生物股份有限公司 2022-02-01 CN claimed
CN-112300012-A Method for preparing 2-methoxy ethylamine hydrochloride 上海睿瓦科技有限公司 2021-02-02 CN claimed
CN-113993872-B EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2024-09-24 CN disclosed
CN-112384509-B Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-04-30 CN disclosed
CN-117813302-A Substituted tetrahydrofuran-2-carboxamides as sodium channel modulators 沃泰克斯药物股份有限公司 2024-04-02 CN disclosed
CN-113999125-B Preparation method of 2-methoxyethylamine 苏州昊帆生物股份有限公司 2024-03-05 CN disclosed
CN-113999125-B Preparation method of 2-methoxyethylamine 苏州昊帆生物股份有限公司 2024-03-05 CN disclosed
WO-2024044327-A1 DHNT MONOMERS AND POLYMER DYES WITH MODIFIED PHOTOPHYSICAL PROPERTIES BECKMAN COULTER, INC. (US) 2024-02-29 WO disclosed
CN-117529476-A Preparation of substituted 1, 2-diamino heterocyclic derivatives and their use as medicaments 亚飞络思制药公司 2024-02-06 CN disclosed
CN-116997547-A Granulin precursor modulators and methods of use thereof 阿库达医疗公司 2023-11-03 CN disclosed
US-6897305-B2 Calcium channel drugs and uses THERAVANCE, INC. (US) 2005-05-24 US disclosed
CN-1568185-A Compounds affecting glucokinase ASTRAZENECA AB (SE) 2005-01-19 CN disclosed
US-20040242561-A1 Novel calcium channel drugs and uses THERAVANCE BIOPHARMA R&D IP, LLC 2004-12-02 US disclosed
US-20030073127-A1 NOVEL CALCIUM CHANNEL DRUGS AND USES THERAVANCE BIOPHARMA R&D IP, LLC 2003-04-17 US disclosed
WO-1999063992-A9 NOVEL CALCIUM CHANNEL DRUGS AND USES ADVANCED MEDICINE INC (US) 2002-08-22 WO disclosed
EP-1085863-A1 CROSS-REFERENCE TO RELATED APPLICATIONS Advanced Medicine, Inc. (US) 2001-03-28 EP disclosed
EP-1085863-A4 CROSS-REFERENCE TO RELATED APPLICATIONS ADVANCED MEDICINE INC (US) 2001-03-28 EP disclosed
WO-1999063992-A1 NOVEL CALCIUM CHANNEL DRUGS AND USES ADVANCED MEDICINE, INC. (US) 1999-12-16 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 (2 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-20030073127-A1 NOVEL CALCIUM CHANNEL DRUGS AND USES CACNB2, CACNA1B, CACNA1F TDP1 3946/4885MEN1 3664/4885GAA 2662/4885
US-20040242561-A1 Novel calcium channel drugs and uses CACNB2, CACNA1B, CACNA1F TDP1 3946/4885MEN1 3664/4885GAA 2662/4885

“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.