SCHEMBL2296799

SCHEMBL2296799

CS(=O)(=O)Nc1cc2oc(-c3ccc(Cl)cc3)c(C(=O)O)c2cc1C1CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 5/20 0.43
CYP3A4 P08684 4/20 0.43
CYP2C19 P33261 4/20 0.43
KCNH2 Q12809 2/20 0.43
ALOX5 P09917 1/20 0.37
ANO1 Q5XXA6 3/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
SCN9A Q15858 1/20 0.35
FPR1 P21462 1/20 0.35
FPR2 P25090 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MAPK1 P28482 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL2294325 0.90 CYP2C9 (0.53) CYP2C9CYP3A4CYP2C19KCNH2ALOX5
SCHEMBL2295568 0.90 CYP2C9 (0.48) CYP2C9CYP3A4CYP2C19KCNH2ANO1
SCHEMBL6119280 0.87 TRPV1 (0.40) CYP2C9CYP3A4CYP2C19KCNH2ANO1
SCHEMBL6119722 0.86 CYP2C9 (0.45) CYP2C9CYP3A4CYP2C19KCNH2ANO1
SCHEMBL2302690 0.85 CYP2C9 (0.45) CYP2C9CYP3A4CYP2C19KCNH2ANO1
SCHEMBL6120266 0.83 CYP2C9 (0.41) CYP2C9CYP3A4CYP2C19KCNH2ANO1
SCHEMBL2298218 0.82 CYP2C9 (0.48) CYP2C9CYP3A4CYP2C19KCNH2
SCHEMBL14697743 0.81 CYP2C9 (0.47) CYP2C9CYP3A4CYP2C19KCNH2ALOX5
SCHEMBL15458721 0.81 MAPT (0.41) CYP2C9CYP3A4CYP2C19KCNH2ALOX5
SCHEMBL2298467 0.81 CYP2C9 (0.47) CYP2C9CYP3A4CYP2C19KCNH2ANO1

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 CYP2C9 43/4885CYP3A4 25/4885CYP2C19 34/4885
US-20150320777-A1 Therapeutic Methods HAVCR2, SLC10A1, OAT CYP2C9 2142/4885CYP3A4 1989/4885CYP2C19 2218/4885
US-20150080343-A1 Benzofuran Compounds For The Treatment Of Hepatitis C Virus Infections UGT1A1, CYP3A43, ZC3HAV1 CYP2C9 43/4885CYP3A4 25/4885CYP2C19 34/4885
US-10238678-B2 Therapeutic methods HAVCR2, SLC10A1, OAT CYP2C9 2142/4885CYP3A4 1989/4885CYP2C19 2218/4885
US-20140212384-A1 Therapeutic Methods HAVCR2, SLC10A1, OAT CYP2C9 2142/4885CYP3A4 1989/4885CYP2C19 2218/4885

“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.