SCHEMBL7436176

SCHEMBL7436176

CCOC(=O)c1cnc2[nH]ncc2c1C1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.60
CHEK1 O14757 1/20 0.50
CHEK2 O96017 1/20 0.50
JAK3 P52333 9/20 0.45
JAK1 P23458 7/20 0.45
CSNK1D P48730 1/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
NR2F2 P24468 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
LMNA P02545 2/20 0.43
NPC1 O15118 1/20 0.43
S1PR2 O95136 1/20 0.43
XBP1 P17861 1/20 0.43
RAB9A P51151 1/20 0.43
PPP1CA P62136 1/20 0.43

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
SCHEMBL4348883 0.82 PDE4B (0.82) PDE4BJAK3JAK1
SCHEMBL4345837 0.81 PDE4B (0.80) PDE4BJAK3JAK1MEN1ALDH1A1
SCHEMBL14115714 0.79 PDE4B (0.60) PDE4BCHEK1CHEK2JAK3JAK1
SCHEMBL8311913 0.78 PDE4B (0.59) PDE4BCHEK1CHEK2JAK3JAK1
SCHEMBL2772466 0.77 PDE4B (0.58) PDE4BCHEK1CHEK2JAK3JAK1
SCHEMBL4740302 0.77 PDE4B (0.58) PDE4BCHEK1CHEK2JAK3JAK1
SCHEMBL2773376 0.75 PDE4B (1.00) PDE4BCHEK1CHEK2JAK3JAK1
SCHEMBL5173971 0.74 PDE4B (0.55) PDE4BCHEK1CHEK2JAK3JAK1
SCHEMBL14353567 0.73 NUDT1 (0.64) PDE4BCHEK1CHEK2JAK3MEN1
SCHEMBL30424537 0.73 NUDT1 (0.64) PDE4BCHEK1CHEK2JAK3MEN1

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
EP-0355234-A1 Pyrazolopyridine derivatives as antiatherosclerotic and antihypercholesterolemic agents MERRELL DOW PHARMACEUTICALS INC. (US) 1990-02-28 EP disclosed