SCHEMBL4040366

SCHEMBL4040366

FC(F)(F)c1cccc(Nc2ncnc3sc4c(c23)CCCC4)c1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 6/20 0.74
EGFR P00533 4/20 0.71
MAPT P10636 5/20 0.70
MAPK1 P28482 4/20 0.70
RAF1 P04049 3/20 0.70
HTT P42858 3/20 0.70
LMNA P02545 2/20 0.70
MEN1 O00255 1/20 0.66
POLB P06746 1/20 0.66
HPGD P15428 1/20 0.66
KMT2A Q03164 1/20 0.66
FGFR1 P11362 2/20 0.64
MAP2K1 Q02750 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
GAA P10253 1/20 0.59
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
GLA P06280 1/20 0.58

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
SCHEMBL1384007 0.85 CCNA2 (0.67) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL923247 0.85 MKNK1 (1.00) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL924123 0.84 MKNK1 (0.77) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL4045792 0.83 MKNK1 (0.76) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL922549 0.83 EGFR (1.00) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL4039669 0.82 MAPK1 (0.95) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL922886 0.81 MAPT (0.50) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL923360 0.80 MKNK1 (0.71) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL4041935 0.80 MKNK1 (1.00) MKNK1EGFRMAPTMAPK1RAF1
SCHEMBL923658 0.78 FGFR1 (1.00) MKNK1EGFRMAPTMAPK1RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009104027-A1 THERAPEUTIC APPLICATION OF TRICICLIC AROMATIC AND SATURATED BENZO(4,5)THIENO-(2,3-D)PYRIMIDINE DERIVATES, AS WELL AS THEIR THERAPEUTICALLY ACCEPTABLE SALTS VICHEM CHEMIE KUTATÓ KFT (HU) 2009-08-27 WO claimed