SCHEMBL2368495

SCHEMBL2368495

Clc1nc(NCc2ccccn2)c2c(-c3ccccc3)csc2n1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.73
TNF P01375 2/20 0.70
NOD1 Q9Y239 2/20 0.70
MAPK1 P28482 1/20 0.70
KCNA5 P22460 7/20 0.65
JAK2 O60674 2/20 0.65
CDK2 P24941 2/20 0.65
TYK2 P29597 2/20 0.65
GSK3B P49841 2/20 0.65
JAK3 P52333 2/20 0.65
BTK Q06187 2/20 0.65
AURKB Q96GD4 2/20 0.65
IRAK4 Q9NWZ3 2/20 0.65
IGF1R P08069 1/20 0.65
PIM1 P11309 1/20 0.65
SRC P12931 1/20 0.65
CSNK2A2 P19784 1/20 0.65
JAK1 P23458 1/20 0.65
CCNE1 P24864 1/20 0.65
FLT4 P35916 1/20 0.65

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
SCHEMBL3385334 0.91 ESR1 (0.61) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL2368912 0.87 TNF (0.67) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL2368545 0.86 TNF (0.70) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL3382742 0.86 TNF (0.70) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL2368773 0.84 ESR1 (0.70) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL20665775 0.84 TNF (0.67) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL2368584 0.84 TNF (0.67) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL3383435 0.84 TNF (0.67) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL31336894 0.84 TNF (0.67) ESR1TNFNOD1MAPK1KCNA5
SCHEMBL3381249 0.84 TNF (0.66) ESR1TNFNOD1MAPK1KCNA5

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
US-9249155-B2 Thieno [2, 3-D] pyrimidine derivatives and their use to treat arrhythmia XENTION LIMITED (GB) 2016-02-02 US disclosed
US-9249155-B2 Thieno [2, 3-D] pyrimidine derivatives and their use to treat arrhythmia XENTION LIMITED (GB) 2016-02-02 US disclosed
US-9249155-B2 Thieno [2, 3-D] pyrimidine derivatives and their use to treat arrhythmia XENTION LIMITED (GB) 2016-02-02 US disclosed
EP-2694518-B1 THIENO[2,3-D]PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA XENTION LTD (GB) 2015-10-07 EP disclosed
US-20140206703-A1 THIENO [2, 3-D] PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA XENTION LIMITED (GB) 2014-07-24 US disclosed
US-20140206703-A1 THIENO [2, 3-D] PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA XENTION LIMITED (GB) 2014-07-24 US disclosed
US-20140206703-A1 THIENO [2, 3-D] PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA XENTION LIMITED (GB) 2014-07-24 US disclosed
EP-2694518-A1 THIENO [2, 3 -D]PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA Xention Limited (GB) 2014-02-12 EP disclosed
CN-1823071-B Thienopyrimidine derivatives as potassium channel inhibitors XENTION DISCOVERY LTD 2012-12-19 CN disclosed
WO-2012131379-A1 THIENO [2, 3 -D] PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA XENTION LIMITED (GB) 2012-10-04 WO disclosed
WO-2012131379-A1 THIENO [2, 3 -D] PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA XENTION LIMITED (GB) 2012-10-04 WO disclosed
US-8022076-B2 Thieno[2,3-d]pyrimidine derivatives as potassium channel modulators; antiarrhythmia agents XENTION LIMITED (GB) 2011-09-20 US disclosed
EP-1641803-B3 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2010-12-08 EP disclosed
EP-1641803-B1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2009-03-18 EP disclosed
CN-1823071-A Thienopyrimidine derivatives as potassium channel inhibitors XENTION DISCOVERY LTD (GB) 2006-08-23 CN disclosed
EP-1641803-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS Xention Discovery Limited (GB) 2006-04-05 EP disclosed
US-20050026935-A1 Compounds XENTION DISCOVERY LTD. 2005-02-03 US disclosed
WO-2004111057-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION DISCOVERY LIMITED (GB) 2004-12-23 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 (2 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-20140206703-A1 THIENO [2, 3-D] PYRIMIDINE DERIVATIVES AND THEIR USE TO TREAT ARRHYTHMIA KCNJ2, KCNH2, KCNH1 ESR1 4466/4885TNF 4772/4885NOD1 1470/4885
US-20050026935-A1 Compounds KCNJ11, KCNJ1, KCNH1 ESR1 4494/4885TNF 2689/4885NOD1 2052/4885

“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.