SCHEMBL19594830

SCHEMBL19594830

CC(C)COC(=O)CN(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.43
▸ ALDH1A1 P00352 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CA12 O43570 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ GAA P10253 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NR1H3 Q13133 1/20 0.34
▸ PPARG P37231 1/20 0.33
▸ NCOA2 Q15596 1/20 0.33
▸ NCOA1 Q15788 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32

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
SCHEMBL23065597 0.83 TSHR (0.41) TSHRALDH1A1TDP1L3MBTL1CA12
SCHEMBL19257403 0.81 TSHR (0.39) TSHRALDH1A1TDP1L3MBTL1CA12
SCHEMBL16782927 0.80 TSHR (0.42) TSHRALDH1A1TDP1L3MBTL1CA12
SCHEMBL26778457 0.80 TSHR (0.42) TSHRALDH1A1TDP1L3MBTL1GAA
SCHEMBL21031587 0.78 TSHR (0.45) TSHRALDH1A1TDP1L3MBTL1GAA
SCHEMBL28225850 0.78 TSHR (0.41) TSHRALDH1A1TDP1L3MBTL1CA12
SCHEMBL10081255 0.78 MEN1 (0.42) TSHRALDH1A1TDP1L3MBTL1GAA
SCHEMBL22703844 0.78 TSHR (0.37) TSHRALDH1A1TDP1L3MBTL1CA12
SCHEMBL23502042 0.78 TSHR (0.41) TSHRALDH1A1TDP1L3MBTL1CA12
SCHEMBL16782926 0.77 CA1 (0.40) TSHRALDH1A1TDP1L3MBTL1CA1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024121290-A1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS AND USES THEREOF GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.4) LIMITED (GB) 2024-06-13 — — WO disclosed
US-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. 2024-02-29 — — US disclosed
US-20230151024-A1 STING AGONISTIC COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2023-05-18 — — US disclosed
US-20230141284-A1 CANCER THERAPEUTIC METHOD ONO PHARMACEUTICAL CO., LTD. (JP) 2023-05-11 — — US disclosed
WO-2018093717-A1 COMPOSITIONS AND METHODS FOR TREATING HCV INFECTION ABBVIE INC. (US) 2018-05-24 — — WO disclosed
EP-2890677-B1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2017-11-15 — — 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 (3 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-20230141284-A1 CANCER THERAPEUTIC METHOD STING1, CGAS, IFNAR1 TSHR 1449/4885ALDH1A1 3843/4885TDP1 1840/4885
US-20230151024-A1 STING AGONISTIC COMPOUND STING1, CGAS, TLR1 TSHR 1797/4885ALDH1A1 3607/4885TDP1 540/4885
US-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS MPO, CAT, SOD1 TSHR 2529/4885ALDH1A1 570/4885TDP1 134/4885

“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.

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