SCHEMBL2368451

SCHEMBL2368451

c1ccc(CNc2ncnc3scc(-c4ccc5c(c4)OCO5)c23)nc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.69
TNF P01375 2/20 0.69
NOD1 Q9Y239 2/20 0.69
PIP4K2C Q8TBX8 3/20 0.61
ALDH1A1 P00352 7/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
POLB P06746 1/20 0.60
PKM P14618 1/20 0.60
CLK4 Q9HAZ1 5/20 0.52
DYRK1A Q13627 3/20 0.52
RET P07949 1/20 0.50
FYN P06241 1/20 0.49
LMNA P02545 5/20 0.48
CYP1A2 P05177 4/20 0.48
CYP2D6 P10635 4/20 0.48
CYP2C9 P11712 3/20 0.48
TSHR P16473 3/20 0.48
CYP2C19 P33261 3/20 0.48
HSD17B10 Q99714 3/20 0.48

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
SCHEMBL3383020 0.94 TNF (0.69) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL2369182 0.86 CLK4 (0.52) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL3384947 0.86 TNF (0.68) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL2368728 0.83 MAPK1 (0.49) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL2368531 0.82 CLK4 (0.49) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL2368286 0.82 CLK4 (0.49) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL2369019 0.82 MAPK1 (1.00) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL3382731 0.82 TNF (0.74) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL3381243 0.82 TNF (0.74) MAPK1TNFNOD1PIP4K2CALDH1A1
SCHEMBL6359798 0.82 CLK4 (0.48) MAPK1TNFNOD1PIP4K2CALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8022076-B2 Thieno[2,3-d]pyrimidine derivatives as potassium channel modulators; antiarrhythmia agents XENTION LIMITED (GB) 2011-09-20 US claimed
EP-1641803-B3 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2010-12-08 EP claimed
EP-1641803-B1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2009-03-18 EP claimed
EP-1641803-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS Xention Discovery Limited (GB) 2006-04-05 EP claimed
US-20050026935-A1 Compounds XENTION DISCOVERY LTD. 2005-02-03 US claimed
WO-2004111057-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION DISCOVERY LIMITED (GB) 2004-12-23 WO claimed
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
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 (1 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-20050026935-A1 Compounds KCNJ11, KCNJ1, KCNH1 MAPK1 667/4885TNF 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.