SCHEMBL2368985

SCHEMBL2368985

c1ccc(-c2csc3ncnc(NCc4ccoc4)c23)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.65
CDK8 P49336 1/20 0.65
MAPK1 P28482 3/20 0.64
TNF P01375 1/20 0.64
NOD1 Q9Y239 1/20 0.64
LMNA P02545 6/20 0.54
HTT P42858 3/20 0.54
NCOA1 Q15788 1/20 0.54
NCOA3 Q9Y6Q9 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 3/20 0.53
FGFR1 P11362 5/20 0.51
ESR1 P03372 1/20 0.51
KDM4E B2RXH2 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
PIP4K2C Q8TBX8 2/20 0.50
THRB P10828 1/20 0.48
CSNK2A2 P19784 1/20 0.48
PTPN5 P54829 1/20 0.48
CSNK2B P67870 1/20 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
SCHEMBL2369277 0.87 CCNC (0.78) CCNCCDK8MAPK1TNFNOD1
SCHEMBL2368308 0.81 MAPK1 (0.65) CCNCCDK8MAPK1TNFNOD1
SCHEMBL2368858 0.80 MAPK1 (0.67) CCNCCDK8MAPK1TNFNOD1
SCHEMBL2368872 0.78 MAPK1 (0.71) CCNCCDK8MAPK1TNFNOD1
SCHEMBL2369019 0.78 MAPK1 (1.00) CCNCCDK8MAPK1TNFNOD1
SCHEMBL2369595 0.77 MAPK1 (0.63) CCNCCDK8MAPK1TNFNOD1
SCHEMBL23598908 0.77 CCNC (0.67) CCNCCDK8MAPK1TNFNOD1
SCHEMBL31336990 0.77 CCNC (0.67) CCNCCDK8MAPK1TNFNOD1
SCHEMBL3386632 0.76 MAPK1 (0.62) CCNCCDK8MAPK1TNFNOD1
SCHEMBL3169227 0.76 MAPK1 (0.65) CCNCCDK8MAPK1TNFNOD1

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