SCHEMBL3156451

SCHEMBL3156451

CNC(=O)Oc1cc(-c2ccnn2-c2ccc(Cl)cc2)c(C)n(-c2cccc(C(F)(F)F)c2)c1=O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.61
CCR1 P32246 7/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 3/20 0.41
HSP90AA1 P07900 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPBWR1 P48145 1/20 0.39
MCHR1 Q99705 1/20 0.39
MAT2A P31153 1/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
NPY5R Q15761 2/20 0.37
CYP1A2 P05177 1/20 0.37
NOTUM Q6P988 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
SCHEMBL3150989 0.93 ELANE (0.62) ELANECCR1MEN1KMT2ANPSR1
SCHEMBL2273635 0.86 ELANE (0.81) ELANECCR1MEN1KMT2AMAPT
SCHEMBL27749321 0.83 ELANE (0.66) ELANECCR1MEN1KMT2AMAPT
SCHEMBL597391 0.79 ELANE (0.58) ELANECCR1MEN1KMT2AMAPT
SCHEMBL2277940 0.78 ELANE (0.82) ELANECCR1MEN1KMT2AMAPT
SCHEMBL3147872 0.78 ELANE (0.60) ELANE
SCHEMBL27848638 0.77 ELANE (0.49) ELANECCR1MEN1KMT2AMAPT
SCHEMBL3656275 0.77 ELANE (0.51) ELANECCR1MEN1KMT2AMAPT
SCHEMBL2273394 0.76 ELANE (1.00) ELANECCR1MEN1KMT2A
SCHEMBL4452188 0.76 KMT2A (0.51) ELANECCR1MEN1KMT2AMAPT

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-2018375-B1 2-PYRIDONE DERIVATIVES FOR THE TREATMENT OF DISEASE OR CONDITION IN WHICH INHIBITION OF NEUTROPHIL ELASTASE ACTIVITY IS BENEFICIAL. ASTRAZENECA AB (SE) 2010-03-03 EP claimed