SCHEMBL7410608

SCHEMBL7410608

NC(=O)N(c1ccc(C2=NCCc3ccc(F)cc32)cc1)c1ccccc1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 3/20 0.36
PLG P00747 1/20 0.35
PLAU P00749 1/20 0.35
PLAT P00750 1/20 0.35
KLK1 P06870 1/20 0.35
DHODH Q02127 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 2/20 0.32
SCN9A Q15858 2/20 0.32
KDR P35968 1/20 0.32
CYP11B2 P19099 1/20 0.31
HDAC1 Q13547 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CHRM5 P08912 1/20 0.30

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
SCHEMBL7406251 0.86 PLG (0.41) MAPK10PLGPLAUPLATKLK1
SCHEMBL7406970 0.84 MAPK10 (0.38) MAPK10PLGPLAUPLATKLK1
SCHEMBL7405526 0.83 MAPK10 (0.36) MAPK10PLGPLAUPLATKLK1
SCHEMBL7449476 0.81 MAPK10 (0.42) MAPK10PLGPLAUPLATKLK1
SCHEMBL7408189 0.80 PLG (0.39) MAPK10PLGPLAUPLATKLK1
SCHEMBL7400299 0.80 MAPK10 (0.40) MAPK10PLGPLAUPLATKLK1
SCHEMBL7399046 0.80 MAPK10 (0.39) MAPK10PLGPLAUPLATKLK1
SCHEMBL7404062 0.80 MAPK10 (0.43) MAPK10PLGPLAUPLATKLK1
SCHEMBL7410057 0.79 MAPK10 (0.48) MAPK10CA1CA2CA7CA9
SCHEMBL7401465 0.79 MAPK10 (0.41) MAPK10PLGPLAUPLATKLK1

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-2002040449-A1 DIHYDROISOQUINOLINES AS NOVEL PHOSPHODIESTERASE INHIBITORS ALTANA PHARMA AG (DE) 2002-05-23 WO disclosed