SCHEMBL470779

SCHEMBL470779

CS(=O)(=O)Oc1ccc2c(=O)c(-c3ccc(Br)cc3)coc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.60
XDH P47989 1/20 0.56
MAPT P10636 7/20 0.55
NPC1 O15118 6/20 0.55
RAB9A P51151 6/20 0.55
ALDH1A1 P00352 5/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
KDM4E B2RXH2 3/20 0.55
TP53 P04637 2/20 0.55
CYP3A4 P08684 2/20 0.55
HPGD P15428 2/20 0.55
PDK1 Q15118 1/20 0.54
PDK2 Q15119 1/20 0.54
MAOA P21397 7/20 0.53
MAOB P27338 7/20 0.53
HDAC6 Q9UBN7 2/20 0.53
BCL2 P10415 1/20 0.53
CYP2D6 P10635 1/20 0.53

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
SCHEMBL29498117 1.00 STS (0.60) STSXDHMAPTNPC1RAB9A
SCHEMBL12238001 0.89 STS (0.61) STSXDHMAPTNPC1RAB9A
SCHEMBL15237453 0.88 STS (0.63) STSXDHMAPTNPC1RAB9A
SCHEMBL16401100 0.88 XDH (0.73) XDHMAPTNPC1RAB9AALDH1A1
SCHEMBL12238018 0.88 STS (0.77) STSXDHMAPTNPC1RAB9A
SCHEMBL16400664 0.86 STS (0.58) STSXDHMAPTNPC1RAB9A
SCHEMBL17718166 0.85 STS (0.57) STSXDHMAPTNPC1RAB9A
SCHEMBL17718161 0.85 STS (0.57) STSXDHMAPTNPC1RAB9A
SCHEMBL17718181 0.85 STS (0.57) STSXDHMAPTNPC1RAB9A
SCHEMBL13774686 0.85 XDH (0.76) XDHMAPTNPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2918273-B1 METHODS AND CELLS FOR IDENTIFYING RIG-I PATHWAY REGULATORS KINETA INC (US) 2016-12-21 EP disclosed
US-9458492-B2 Methods and cells for identifying RIG-I pathway regulators Kineta, Inc. (US) 2016-10-04 US disclosed
US-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
US-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
US-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
WO-2016073947-A1 ANTI-VIRAL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF Kineta, Inc. (US) 2016-05-12 WO disclosed
US-20160122312-A1 ANTI-VIRAL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREOF Kineta, Inc. 2016-05-05 US disclosed
US-20160122312-A1 ANTI-VIRAL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREOF Kineta, Inc. 2016-05-05 US disclosed
EP-2560652-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2013-02-27 EP disclosed
US-20130039887-A1 Methods of Identifying and Using Anti-Viral Compounds Kineta, Inc. (US) 2013-02-14 US disclosed
US-20130039887-A1 Methods of Identifying and Using Anti-Viral Compounds Kineta, Inc. (US) 2013-02-14 US disclosed
WO-2012154271-A2 METHOD AND CELLS FOR IDENTIFYING RIG-I PATHWAY REGULATORS Kineta, Inc. (US) 2012-11-15 WO disclosed
WO-2012003030-A9 METHODS OF IDENTIFYING & USING ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2012-03-15 WO disclosed
WO-2012003030-A2 METHODS OF IDENTIFYING & USING ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2012-01-05 WO disclosed
US-20110262482-A1 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 US disclosed
US-20110262482-A1 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 US disclosed
WO-2011133728-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 WO disclosed
WO-2011133728-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 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 (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-20110262482-A1 ANTI-VIRAL COMPOUNDS MAVS, EIF2AK2, IRF3 STS 4884/4885XDH 2936/4885MAPT 3520/4885
US-20130039887-A1 Methods of Identifying and Using Anti-Viral Compounds MAVS, EIF2AK2, DDX5 STS 4871/4885XDH 1265/4885MAPT 4165/4885
US-20160122312-A1 ANTI-VIRAL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREOF MAVS, EIF2AK2, IRF3 STS 4837/4885XDH 1629/4885MAPT 3846/4885

“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.