SCHEMBL7400299

SCHEMBL7400299

CC(C)(C)c1ccc(N(C(N)=O)c2ccc(C3=NCCc4ccc(F)cc43)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 2/20 0.40
CA1 P00915 4/20 0.35
CA2 P00918 4/20 0.35
CA7 P43166 4/20 0.35
CA9 Q16790 4/20 0.35
CA14 Q9ULX7 4/20 0.35
DHODH Q02127 2/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
HTT P42858 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PLG P00747 1/20 0.33
PLAU P00749 1/20 0.33
PLAT P00750 1/20 0.33
KLK1 P06870 1/20 0.33
TNKS O95271 1/20 0.32
PARP1 P09874 1/20 0.32

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
SCHEMBL7449476 0.88 MAPK10 (0.42) MAPK10CA1CA2CA7CA9
SCHEMBL7406970 0.88 MAPK10 (0.38) MAPK10CA1CA2CA7CA9
SCHEMBL7406251 0.87 PLG (0.41) MAPK10CA1CA2CA7CA9
SCHEMBL7401465 0.86 MAPK10 (0.41) MAPK10CA1CA2CA7CA9
SCHEMBL7399046 0.85 MAPK10 (0.39) MAPK10CA1CA2CA7CA9
SCHEMBL7405526 0.84 MAPK10 (0.36) MAPK10CA1CA2CA7CA9
SCHEMBL7408668 0.82 MAPK10 (0.38) MAPK10CA1CA2CA7CA9
SCHEMBL7405026 0.82 MAPK10 (0.40) MAPK10CA1CA2CA7CA9
SCHEMBL7408189 0.82 PLG (0.39) MAPK10CA1CA2CA7CA9
SCHEMBL7410608 0.80 MAPK10 (0.36) MAPK10CA1CA2CA7CA9

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