SCHEMBL20101972

SCHEMBL20101972

O=C(OCC(F)(F)F)c1occc(=O)c1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
LMNA P02545 2/20 0.52
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
XBP1 P17861 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAOB P27338 4/20 0.41
MAOA P21397 3/20 0.40
KCNA2 P16389 1/20 0.39
KCNA5 P22460 1/20 0.39
KCNA1 Q09470 1/20 0.39
KCNA3 P22001 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 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
SCHEMBL4545472 0.84 LMNA (0.63) GAALMNANPC1RAB9ASMN1; SMN2
SCHEMBL4545464 0.81 LMNA (0.62) GAALMNANPC1RAB9ASMN1; SMN2
SCHEMBL86223 0.81 LMNA (0.64) GAALMNASMN1; SMN2MAOBMAOA
SCHEMBL14129739 0.78 LMNA (0.61) GAALMNANPC1SMN1; SMN2MAOB
SCHEMBL1772322 0.75 LMNA (0.54) GAALMNAMAPTSMN1; SMN2MAOB
SCHEMBL13226830 0.75 LMNA (0.60) GAALMNANPC1MAPTRAB9A
SCHEMBL20101965 0.74 SMN1; SMN2 (0.43) GAALMNANPC1MAPTXBP1
SCHEMBL23223241 0.73 LMNA (0.58) GAALMNASMN1; SMN2MAOBMAOA
SCHEMBL19329810 0.73 LMNA (0.58) GAALMNANPC1RAB9ASMN1; SMN2
SCHEMBL21975951 0.72 LMNA (0.56) GAALMNANPC1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3391888-B1 MEDICINE FOR TREATING INFLUENZA CHARACTERIZED BY COMPRISING COMBINATION OF CAP-DEPENDENT ENDONUCLEASE INHIBITOR WITH ANTI-INFLUENZA DRUG SHIONOGI & CO (JP) 2023-09-27 EP 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
EP-4219508-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVE AND PRODRUG THEREOF Shionogi & Co., Ltd (JP) 2023-08-02 EP disclosed
EP-3290424-B1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF SHIONOGI & CO (JP) 2023-01-04 EP disclosed
US-11040048-B2 Medicament for treating influenza characterized by combining a Cap-dependent endonuclease inhibitor and an anti-influenza drug SHIONOGI & CO., LTD. (JP) 2021-06-22 US disclosed
US-20200361958-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF SHIONOGI & CO., LTD. (JP) 2020-11-19 US disclosed
US-20200283455-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF SHIONOGI & CO., LTD. (JP) 2020-09-10 US disclosed
US-10759814-B2 Pharmaceutical compositions containing substituted polycyclic pyridone derivatives and prodrug thereof SHIONOGI & CO., LTD. (JP) 2020-09-01 US disclosed
US-20200261481-A1 A MEDICAMENT FOR TREATING INFLUENZA CHARACTERIZED BY COMBINING A CAP-DEPENDENT ENDONUCLEASE INHIBITOR AND AN ANTI-INFLUENZA DRUG SHIONOGI & CO., LTD. (JP) 2020-08-20 US disclosed
US-10633397-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof SHIONOGI & CO., LTD. (JP) 2020-04-28 US disclosed
US-10392406-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof SHIONOGI & CO., LTD. (JP) 2019-08-27 US 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 (12 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-20200361958-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF TYMP, PNP, CYP3A4 GAA 628/4885LMNA 1759/4885NPC1 1738/4885
US-20230287004-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 GAA 4535/4885LMNA 1318/4885NPC1 3542/4885
US-20190169206-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF TYMP, PNP, CYP3A4 GAA 628/4885LMNA 1759/4885NPC1 1738/4885
US-10294241-B2 C3AR1, HAVCR2, NR4A1 GAA 4432/4885LMNA 2068/4885NPC1 2041/4885
US-10633397-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof C3AR1, NR4A1, HAVCR2 GAA 4535/4885LMNA 1318/4885NPC1 3542/4885
US-10392406-B2 Substituted polycyclic pyridone derivatives and prodrugs thereof C3AR1, NR4A1, HAVCR2 GAA 4535/4885LMNA 1318/4885NPC1 3542/4885
US-20190112315-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 GAA 4535/4885LMNA 1318/4885NPC1 3542/4885
US-20200283455-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 GAA 4535/4885LMNA 1318/4885NPC1 3542/4885
US-10759814-B2 Pharmaceutical compositions containing substituted polycyclic pyridone derivatives and prodrug thereof TYMP, PNP, CYP3A4 GAA 628/4885LMNA 1759/4885NPC1 1738/4885
US-20200261481-A1 A MEDICAMENT FOR TREATING INFLUENZA CHARACTERIZED BY COMBINING A CAP-DEPENDENT ENDONUCLEASE INHIBITOR AND AN ANTI-INFLUENZA DRUG RNASEH1, RNASEL, RNPEP GAA 1320/4885LMNA 1560/4885NPC1 2543/4885
US-20180118760-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 GAA 4535/4885LMNA 1318/4885NPC1 3542/4885
US-11040048-B2 Medicament for treating influenza characterized by combining a Cap-dependent endonuclease inhibitor and an anti-influenza drug RNASEH1, RNPEP, RNASEL GAA 1583/4885LMNA 1825/4885NPC1 2423/4885

“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.