SCHEMBL20101953

SCHEMBL20101953

CCOC(=O)c1c(OCc2ccccc2)c(=O)ccn1NC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 2/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
SYK P43405 1/20 0.40
NPC1 O15118 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 2/20 0.39
PPIA P62937 2/20 0.38
AKT1 P31749 3/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL10188411 0.91 HPGD (0.44) SMN1; SMN2HTTHPGDMEN1ALDH1A1
Water SCHEMBL28917805 0.90 HPGD (0.43) SMN1; SMN2HTTHPGDMEN1ALDH1A1
SCHEMBL20101966 0.89 SMN1; SMN2 (0.38) SMN1; SMN2HTTHPGDMEN1ALDH1A1
SCHEMBL21185002 0.89 HTT (0.44) SMN1; SMN2HTTHPGDMEN1ALDH1A1
SCHEMBL23418413 0.86 BRD4 (0.40) SMN1; SMN2HTTHPGDMEN1ALDH1A1
SCHEMBL22508485 0.86 SMN1; SMN2 (0.41) SMN1; SMN2HTTHPGDMEN1ALDH1A1
SCHEMBL23223246 0.84 SYK (0.39) SMN1; SMN2HTTHPGDMEN1ALDH1A1
SCHEMBL25024299 0.84 MKNK2 (0.40) ALDH1A1KMT2ACRHBPCRHR2GAA
SCHEMBL25750671 0.84 HTT (0.40) SMN1; SMN2HTTHPGDMEN1ALDH1A1
SCHEMBL31084272 0.83 HTT (0.43) SMN1; SMN2HTTHPGDMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114907365-B Influenza virus inhibitor and application thereof 扬子江药业集团有限公司 2023-12-01 CN disclosed
CN-117120441-A Influenza virus inhibitor and application thereof 扬子江药业集团有限公司 2023-11-24 CN disclosed
US-20230287004-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF SHIONOGI & CO., LTD. (JP) 2023-09-14 US disclosed
US-20230287004-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF SHIONOGI & CO., LTD. (JP) 2023-09-14 US disclosed
US-20230144122-A1 PYRIDONE DERIVATIVE CRYSTAL FORM AND PREPARATION METHOD AND APPLICATION THEREFOR JIANGXI CAISHI PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) 2023-05-11 US disclosed
US-20230144122-A1 PYRIDONE DERIVATIVE CRYSTAL FORM AND PREPARATION METHOD AND APPLICATION THEREFOR JIANGXI CAISHI PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) 2023-05-11 US disclosed
US-20230040262-A1 STEREOSELECTIVE PROCESS FOR PREPARING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2023-02-09 US disclosed
WO-2022171198-A1 INFLUENZA VIRUS INHIBITOR AND USE THEREOF 扬子江药业集团有限公司 2022-08-18 WO disclosed
CN-114907365-A Influenza virus inhibitor and application thereof 扬子江药业集团有限公司 2022-08-16 CN disclosed
US-20220177487-A1 FUSED POLYCYCLIC PYRIDONE COMPOUNDS AS INFLUENZA VIRUS REPLICATION INHIBITORS NIKANG THERAPEUTICS, INC. 2022-06-09 US disclosed
EP-3686201-A1 INFLUENZA VIRUS REPLICATION INHIBITOR AND USE THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2020-07-29 EP disclosed
US-10633397-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof SHIONOGI & CO., LTD. (JP) 2020-04-28 US disclosed
WO-2019196891-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF 安帝康(无锡)生物科技有限公司 2019-10-17 WO disclosed
US-10392406-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof SHIONOGI & CO., LTD. (JP) 2019-08-27 US disclosed
WO-2019141179-A1 PYRIDONE DERIVATIVE, COMPOSITION THEREOF AND APPLICATION THEREOF AS ANTI-INFLUENZA DRUG 银杏树药业(苏州)有限公司 2019-07-25 WO disclosed
US-20190169206-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF SHIONOGI & CO., LTD. (JP) 2019-06-06 US disclosed
US-10294241-B2 2019-05-21 US disclosed
US-20190112315-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF SHIONOGI & CO., LTD. (JP) 2019-04-18 US disclosed
US-20180118760-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF SHIONOGI & CO., LTD. (JP) 2018-05-03 US disclosed
US-20180118760-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF SHIONOGI & CO., LTD. (JP) 2018-05-03 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 (10 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-20230040262-A1 STEREOSELECTIVE PROCESS FOR PREPARING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES RNGTT, CPSF6, RNASEL SMN1; SMN2 2614/4885HTT 4786/4885HPGD 1499/4885
US-20230287004-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 SMN1; SMN2 3547/4885HTT 4544/4885HPGD 2908/4885
US-20190169206-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF TYMP, PNP, CYP3A4 SMN1; SMN2 1950/4885HTT 3721/4885HPGD 396/4885
US-10294241-B2 C3AR1, HAVCR2, NR4A1 SMN1; SMN2 3158/4885HTT 3185/4885HPGD 4853/4885
US-10633397-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof C3AR1, NR4A1, HAVCR2 SMN1; SMN2 3547/4885HTT 4544/4885HPGD 2908/4885
US-10392406-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof C3AR1, NR4A1, HAVCR2 SMN1; SMN2 3547/4885HTT 4544/4885HPGD 2908/4885
US-20190112315-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 SMN1; SMN2 3547/4885HTT 4544/4885HPGD 2908/4885
US-20220177487-A1 FUSED POLYCYCLIC PYRIDONE COMPOUNDS AS INFLUENZA VIRUS REPLICATION INHIBITORS PDXK, PNPO, CDKN1A SMN1; SMN2 3213/4885HTT 4698/4885HPGD 810/4885
US-20180118760-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 SMN1; SMN2 3547/4885HTT 4544/4885HPGD 2908/4885
US-20230144122-A1 PYRIDONE DERIVATIVE CRYSTAL FORM AND PREPARATION METHOD AND APPLICATION THEREFOR CYP51A1, CYP2F1, SFRP1 SMN1; SMN2 2917/4885HTT 4118/4885HPGD 816/4885

“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.