SCHEMBL7370703

SCHEMBL7370703

CC(=O)c1cc(Oc2ncccc2C(=O)NCc2ccc(C(C)(C)O)cc2Cl)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 5/20 0.56
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
GAA P10253 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
SCHEMBL7365627 0.89 MAPK8 (0.53) MAPK8
SCHEMBL7368193 0.89 MAPK8 (0.56) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7367759 0.88 MAPK8 (0.56) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7684087 0.88 MAPK8 (0.60) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7371219 0.87 MAPK8 (0.54) MAPK8
SCHEMBL7365167 0.86 MAPK8 (0.59) MAPK8GAA
SCHEMBL4826727 0.85 MAPK8 (0.54) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7369625 0.84 MAPK8 (0.55) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7368548 0.83 MAPK8 (0.51) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7367817 0.82 MAPK8 (0.73) MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1254335-A Nicotinamide derivatives PFIZER PROD INC (US) 2000-05-24 CN disclosed
EP-0971894-A1 NICOTINAMIDE DERIVATIVES Pfizer Products Inc. (US) 2000-01-19 EP disclosed
WO-1998045268-A1 NICOTINAMIDE DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-10-15 WO disclosed