SCHEMBL3387010

SCHEMBL3387010

NC(c1ccco1)c1ncnc2sc(Br)c(-c3ccccc3)c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.34
FGFR1 P11362 3/20 0.33
KDR P35968 3/20 0.33
PRKD3 O94806 2/20 0.33
MAP4K4 O95819 2/20 0.33
LCK P06239 2/20 0.33
CSF1R P07333 2/20 0.33
FLT1 P17948 2/20 0.33
CLK2 P49760 2/20 0.33
BTK Q06187 2/20 0.33
MAP4K2 Q12851 2/20 0.33
NTRK3 Q16288 2/20 0.33
NTRK2 Q16620 2/20 0.33
TAOK1 Q7L7X3 2/20 0.33
CLK4 Q9HAZ1 2/20 0.33
PLK4 O00444 1/20 0.33
AURKA O14965 1/20 0.33
DYRK3 O43781 1/20 0.33
FYN P06241 1/20 0.33
FES P07332 1/20 0.33

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
SCHEMBL3386423 0.83 MCL1 (0.41) KDRKITTEK
SCHEMBL3382775 0.81 EGFR (0.36) LIMK1FGFR1KDRPRKD3MAP4K4
SCHEMBL5792474 0.77 PTGS1 (0.43) MAPTALDH1A1L3MBTL1LMNAMEN1
SCHEMBL2368964 0.74 MAPT (0.34) LIMK1FGFR1KDRPRKD3MAP4K4
SCHEMBL3387014 0.71 SMN1; SMN2 (0.60) KDRMAPTNPSR1ALDH1A1L3MBTL1
SCHEMBL3384503 0.71 MCL1 (0.36) KDRCLK4NPSR1ALDH1A1GAA
SCHEMBL14965012 0.71 SMN1; SMN2 (0.42) LIMK1FGFR1KDRPRKD3MAP4K4
SCHEMBL6359806 0.67 SMN1; SMN2 (0.39) LIMK1FGFR1MAPTALDH1A1HTT
SCHEMBL3384558 0.67 FGFR1 (0.46) LIMK1FGFR1KDRMAPTALDH1A1
SCHEMBL3385441 0.66 ALDH1A1 (0.53) FGFR1KDRPRKD3MAP4K4LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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