SCHEMBL2369043

SCHEMBL2369043

c1ccc(CNc2ncnc3scc(-c4cccs4)c23)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.73
ALDH1A1 P00352 4/20 0.73
TNF P01375 2/20 0.73
NOD1 Q9Y239 2/20 0.73
POLB P06746 1/20 0.73
PKM P14618 1/20 0.73
L3MBTL1 Q9Y468 1/20 0.73
CCNC P24863 1/20 0.59
CDK8 P49336 1/20 0.59
HTT P42858 5/20 0.56
LMNA P02545 4/20 0.56
MAPK1 P28482 1/20 0.55
STAT3 P40763 1/20 0.53
MAPT P10636 3/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
PIP4K2C Q8TBX8 1/20 0.50
ESR1 P03372 1/20 0.48
PDE4A P27815 1/20 0.48
PDE4B Q07343 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
SCHEMBL2369091 0.88 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL3387875 0.86 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL3383720 0.85 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL2369277 0.85 CCNC (0.78) SMN1; SMN2ALDH1A1TNFNOD1CCNC
SCHEMBL2368782 0.82 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL2368835 0.81 SMN1; SMN2 (0.65) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL3382531 0.81 SMN1; SMN2 (0.65) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL2369385 0.81 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL3385124 0.80 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1TNFNOD1POLB
SCHEMBL2368781 0.79 MAPK1 (0.65) SMN1; SMN2ALDH1A1TNFNOD1POLB

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 5 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
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