SCHEMBL5873282

SCHEMBL5873282

C=CCOCC(=O)OCC=C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.61
TSHR P16473 6/20 0.47
CYP3A4 P08684 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 1/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
ALDH1A1 P00352 8/20 0.37
HSD17B10 Q99714 6/20 0.37
KDM4E B2RXH2 4/20 0.37
HPGD P15428 4/20 0.37
GAA P10253 1/20 0.37
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
EPHX2 P34913 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
SCHEMBL8063306 0.98 TDP1 (0.59) TDP1TSHRCYP3A4NPSR1PKM
SCHEMBL3430807 0.93 TDP1 (0.63) TDP1TSHRCYP3A4NPSR1PKM
SCHEMBL11490547 0.85 TDP1 (0.56) TDP1TSHRCYP3A4NPSR1PKM
SCHEMBL8775561 0.85 TDP1 (0.47) TDP1TSHRCYP3A4PKMSMN1; SMN2
SCHEMBL1471358 0.85 TDP1 (0.51) TDP1TSHRNPSR1SMN1; SMN2ALDH1A1
SCHEMBL11829533 0.85 TDP1 (0.56) TDP1TSHRCYP3A4NPSR1PKM
SCHEMBL8670951 0.85 TDP1 (0.61) TDP1TSHRCYP3A4NPSR1PKM
SCHEMBL11357983 0.83 TDP1 (0.59) TDP1TSHRCYP3A4NPSR1PKM
SCHEMBL4558499 0.83 TDP1 (0.64) TDP1TSHRCYP3A4NPSR1PKM
SCHEMBL19296598 0.81 TDP1 (0.67) TDP1TSHRCYP3A4NPSR1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190023692-A1 QUINOXALINONES AND DIHYDROQUINOXALINONES AS RESPIRATORY SYNCYTIAL VIRUS ANTIVIRAL AGENTS JANSSEN SCIENCES IRELAND UC (IE) 2019-01-24 US disclosed
US-10081618-B2 Quinoxalinones and dihydroquinoxalinones as respiratory syncytial virus ativiral agents JANSSEN SCIENCES IRELAND UC (IE) 2018-09-25 US disclosed
EP-3131905-B1 SPIRO UREA COMPOUNDS AS RSV ANTIVIRAL COMPOUNDS JANSSEN SCIENCES IRELAND UC (IE) 2018-02-28 EP disclosed
US-9890178-B2 Azabenzimidazoles as respiratory syncytial virus antiviral agents JANSSEN SCIENCES IRELAND UC (IE) 2018-02-13 US disclosed
US-9845321-B2 1,3-dihydro-2H-benzimidazol-2-one derivatives substituted with heterocycles as respiratory syncytial virus antiviral agents JANSSEN SCIENCES IRELAND UC (IE) 2017-12-19 US disclosed
US-20170260166-A1 QUINOXALINONES AND DIHYDROQUINOXALINONES AS RESPIRATORY SYNCYTIAL VIRUS ATIVIRAL AGENTS JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-09-14 US disclosed
US-9738652-B2 Spiro urea compounds as RSV antiviral compounds JANSSEN SCIENCES IRELAND UC (IE) 2017-08-22 US disclosed
EP-2909195-B1 RSV ANTIVIRAL COMPOUNDS JANSSEN SCIENCES IRELAND UC (IE) 2017-06-14 EP disclosed
US-9617289-B2 RSV antiviral compounds JANSSEN SCIENCES IRELAND UC (IE) 2017-04-11 US disclosed
EP-3131905-A1 SPIRO UREA COMPOUNDS AS RSV ANTIVIRAL COMPOUNDS Janssen Sciences Ireland UC (IE) 2017-02-22 EP disclosed
US-20060079711-A1 Method of producing diol derivatives HAYASHI TOSHIO 2006-04-13 US disclosed
US-7005536-B2 Method for producing diol derivatives NIPPON SHOKUBAI CO., LTD. (JP) 2006-02-28 US disclosed
EP-1553076-A1 PROCESS FOR PRODUCING DIOL DERIVATIVE Nippon Shokubai Co., Ltd. (JP) 2005-07-13 EP disclosed
US-20040138409-A1 Method for producing diol derivatives NIPPON SHOKUBAI CO., LTD. (JP) 2004-07-15 US disclosed
EP-0082188-B1 FLEXIBLE FILM LAMINATES AND RETORTABLE FOOD POUCHES FABRICATED THEREFROM MOBIL OIL CORPORATION (US) 1987-04-08 EP disclosed
EP-0082188-A4 FLEXIBLE FILM LAMINATES AND RETORTABLE FOOD POUCHES FABRICATED THEREFROM. MOBIL OIL CORP (US) 1983-10-06 EP disclosed
EP-0082188-A1 FLEXIBLE FILM LAMINATES AND RETORTABLE FOOD POUCHES FABRICATED THEREFROM. MOBIL OIL CORP (US) 1983-06-29 EP disclosed
WO-1982004429-A1 FLEXIBLE FILM LAMINATES AND RETORTABLE FOOD POUCHES FABRICATED THEREFROM MOBIL OIL CORP (US) 1982-12-23 WO disclosed
US-4360551-A Flexible film laminate especially adapted for use in the construction of a retortable food pouch MOBIL OIL CORPORATION (US) 1982-11-23 US disclosed
US-4126647-A ETHYLENE POLYMER/ACRYLONITRILE POLYMER COMPOSITES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-11-21 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 (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-20190023692-A1 QUINOXALINONES AND DIHYDROQUINOXALINONES AS RESPIRATORY SYNCYTIAL VIRUS ANTIVIRAL AGENTS SQOR, SDHA, DHX15 TDP1 2567/4885TSHR 4855/4885CYP3A4 341/4885
US-20170260166-A1 QUINOXALINONES AND DIHYDROQUINOXALINONES AS RESPIRATORY SYNCYTIAL VIRUS ATIVIRAL AGENTS ATIC, DHX15, SQOR TDP1 2921/4885TSHR 4847/4885CYP3A4 364/4885
US-10081618-B2 Quinoxalinones and dihydroquinoxalinones as respiratory syncytial virus ativiral agents ATIC, DHX15, SQOR TDP1 2921/4885TSHR 4847/4885CYP3A4 364/4885

“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.