SCHEMBL2369141

SCHEMBL2369141

Cc1ccccc1-c1csc2ncnc(NCc3ccccn3)c12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 2/20 0.73
NOD1 Q9Y239 2/20 0.73
MAPK1 P28482 2/20 0.73
ALDH1A1 P00352 4/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
POLB P06746 1/20 0.69
PKM P14618 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
PIP4K2C Q8TBX8 4/20 0.62
HTT P42858 2/20 0.60
RAB9A P51151 1/20 0.60
LMNA P02545 1/20 0.53
GFER P55789 1/20 0.53
EGFR P00533 2/20 0.48
CCNC P24863 1/20 0.48
CDK8 P49336 1/20 0.48
RECQL P46063 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KCNH2 Q12809 1/20 0.43

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
SCHEMBL27640124 0.86 TNF (0.69) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL2368708 0.85 TNF (0.83) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL3381243 0.85 TNF (0.74) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL2369019 0.85 MAPK1 (1.00) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL3385307 0.83 TNF (0.68) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL3387956 0.81 TNF (0.83) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL2368569 0.81 TNF (0.83) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL5789280 0.81 TNF (0.62) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL2368690 0.81 MAPK1 (0.72) TNFNOD1MAPK1ALDH1A1SMN1; SMN2
SCHEMBL2369055 0.81 MAPK1 (0.78) TNFNOD1MAPK1ALDH1A1SMN1; SMN2

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 6 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 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
WO-2004111057-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION DISCOVERY LIMITED (GB) 2004-12-23 WO disclosed