SCHEMBL7408189

SCHEMBL7408189

NC(=O)N(c1ccc(Oc2ccccc2)cc1)c1ccc(C2=NCCc3ccc(F)cc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
PLAT P00750 1/20 0.39
KLK1 P06870 1/20 0.39
SCN9A Q15858 8/20 0.39
DHODH Q02127 3/20 0.39
MAPK10 P53779 2/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
ALOX5 P09917 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36

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 0.92 PLG (0.41) PLGPLAUPLATKLK1SCN9A
SCHEMBL7449476 0.84 MAPK10 (0.42) PLGPLAUPLATKLK1DHODH
SCHEMBL7399046 0.83 MAPK10 (0.39) PLGPLAUPLATKLK1MAPK10
SCHEMBL7401465 0.82 MAPK10 (0.41) PLGPLAUPLATKLK1MAPK10
SCHEMBL7400299 0.82 MAPK10 (0.40) PLGPLAUPLATKLK1DHODH
SCHEMBL7406970 0.82 MAPK10 (0.38) PLGPLAUPLATKLK1DHODH
SCHEMBL7408668 0.80 MAPK10 (0.38) PLGPLAUPLATKLK1MAPK10
SCHEMBL7410608 0.80 MAPK10 (0.36) PLGPLAUPLATKLK1SCN9A
SCHEMBL7405526 0.80 MAPK10 (0.36) PLGPLAUPLATKLK1DHODH
SCHEMBL7405026 0.80 MAPK10 (0.40) PLGPLAUPLATKLK1MAPK10

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