SCHEMBL7903085

SCHEMBL7903085

Cc1c(C2CC=NN2C)cc(C(=O)NCc2ccc(S(C)(=O)=O)cn2)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 0.66

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
SCHEMBL31495992 0.88 ELANE (0.70) ELANE
SCHEMBL4022133 0.88 ELANE (0.70) ELANE
SCHEMBL4126035 0.84 ELANE (0.74) ELANE
SCHEMBL4134848 0.81 ELANE (0.70) ELANE
Alvelestat SCHEMBL30179302 0.80 ELANE (1.00) ELANE
Alvelestat SCHEMBL29519811 0.80 ELANE (1.00) ELANE
Alvelestat SCHEMBL560757 0.80 ELANE (1.00) ELANE
Alvelestat SCHEMBL29740084 0.80 ELANE (1.00) ELANE
SCHEMBL7910137 0.79 NOTUM (0.51) ELANE
SCHEMBL23925515 0.78 ELANE (0.72) ELANE

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-2010094964-A1 TOSYLATE SALT OF A 5-PYRAZOLYL-2-PYRIDONE DERIVATIVE, USEFUL IN THE TREATMENT OF COPD ASTRAZENECA AB (SE) 2010-08-26 WO disclosed