SCHEMBL2299414

SCHEMBL2299414

CCOC(=O)c1c(-c2ccc(Cl)cc2)oc2ccc(OC(C)C)cc12

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.72
KDM4E B2RXH2 7/20 0.65
ALDH1A1 P00352 5/20 0.64
HPGD P15428 5/20 0.64
NPSR1 Q6W5P4 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.63
MAPT P10636 4/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
TSHR P16473 2/20 0.62
HSD17B10 Q99714 2/20 0.62
GAA P10253 2/20 0.62
HTT P42858 1/20 0.62
RCE1 Q9Y256 1/20 0.62
PTGS2 P35354 3/20 0.62

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
SCHEMBL3539261 0.89 KDM4E (0.68) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL2297356 0.89 MAPT (0.69) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL2301063 0.88 ALOX5 (0.57) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL6118981 0.86 KDM4E (0.62) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL2297349 0.84 ALOX5 (1.00) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL3536988 0.84 MAPT (0.68) KDM4EALDH1A1HPGDNPSR1L3MBTL1
SCHEMBL6118735 0.82 KDM4E (0.64) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL3540989 0.80 KDM4E (0.65) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL2301421 0.80 ALOX5 (0.57) ALOX5KDM4EALDH1A1HPGDNPSR1
SCHEMBL20256044 0.79 ALOX5 (0.59) ALOX5KDM4EALDH1A1HPGDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2744342-B1 THERAPEUTIC METHODS GLAXOSMITHKLINE LLC (US) 2019-04-24 EP disclosed
US-10238678-B2 Therapeutic methods GLAXOSMITHKLINE LLC (US) 2019-03-26 US disclosed
EP-3199531-A1 BENZOFURAN COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS Glaxo Group Limited (GB) 2017-08-02 EP disclosed
US-9682999-B2 Benzofuran compounds for the treatment of hepatitis C virus infections GLAXO GROUP LIMITED (GB) 2017-06-20 US disclosed
US-20150320777-A1 Therapeutic Methods GLAXOSMITHKLINE LLC 2015-11-12 US disclosed
US-9119868-B2 Therapeutic methods GLAXOSMITHKLINE LLC (US) 2015-09-01 US disclosed
US-20150080343-A1 Benzofuran Compounds For The Treatment Of Hepatitis C Virus Infections GLAXO GROUP LIMITED (GB) 2015-03-19 US disclosed
US-8927593-B2 Benzofuran compounds for the treatment of hepatitis C virus infections GLAXO GROUP LIMITED (GB) 2015-01-06 US disclosed
US-20140212384-A1 Therapeutic Methods GLAXOSMITHKLINE LLC 2014-07-31 US disclosed
EP-2744332-A1 BENZOFURAN COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS Glaxo Group Limited (GB) 2014-06-25 EP disclosed
EP-2744342-A1 THERAPEUTIC METHODS GlaxoSmithKline LLC (US) 2014-06-25 EP disclosed
US-20130237501-A1 Benzofuran Compounds For The Treatment Of Hepatitis C Virus Infections GLAXO GROUP LIMITED (GB) 2013-09-12 US disclosed
WO-2013028371-A1 BENZOFURAN COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS GLAXO GROUP LIMITED (GB) 2013-02-28 WO disclosed
WO-2013025992-A1 THERAPEUTIC METHODS GLAXOSMITHKLINE LLC (US) 2013-02-21 WO disclosed
WO-2012067663-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-05-24 WO disclosed
WO-2011103063-A1 THERAPEUTIC COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-08-25 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 (5 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-20130237501-A1 Benzofuran Compounds For The Treatment Of Hepatitis C Virus Infections UGT1A1, CYP3A43, ZC3HAV1 ALOX5 1161/4885KDM4E 2496/4885ALDH1A1 59/4885
US-20150320777-A1 Therapeutic Methods HAVCR2, SLC10A1, OAT ALOX5 1534/4885KDM4E 4713/4885ALDH1A1 606/4885
US-20150080343-A1 Benzofuran Compounds For The Treatment Of Hepatitis C Virus Infections UGT1A1, CYP3A43, ZC3HAV1 ALOX5 1161/4885KDM4E 2496/4885ALDH1A1 59/4885
US-10238678-B2 Therapeutic methods HAVCR2, SLC10A1, OAT ALOX5 1534/4885KDM4E 4713/4885ALDH1A1 606/4885
US-20140212384-A1 Therapeutic Methods HAVCR2, SLC10A1, OAT ALOX5 1534/4885KDM4E 4713/4885ALDH1A1 606/4885

“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.