SCHEMBL8348689

SCHEMBL8348689

CCCOC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)N(CC(=O)NC)C1c1ccc(C#N)cc1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 0.75
CYP2C9 P11712 3/20 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
SCHEMBL13412216 0.95 ELANE (0.84) ELANECYP2C9
SCHEMBL8345868 0.89 ELANE (0.83) ELANECYP2C9
SCHEMBL8344175 0.89 ELANE (0.76) ELANECYP2C9
SCHEMBL13872930 0.87 ELANE (0.87) ELANECYP2C9
SCHEMBL13412207 0.87 ELANE (0.89) ELANECYP2C9
SCHEMBL1134161 0.86 ELANE (0.85) ELANECYP2C9
SCHEMBL13412219 0.86 ELANE (0.77) ELANECYP2C9
SCHEMBL1764173 0.86 ELANE (1.00) ELANECYP2C9
SCHEMBL8345071 0.86 ELANE (1.00) ELANECYP2C9
SCHEMBL8344908 0.86 ELANE (0.87) ELANECYP2C9

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-2004024700-A1 PYRIMIDINONE DERIVATIVES AS THERAPEUTIC AGENTS AGAINST ACUTE AND CHRONIC INFLAMMATORY, ISCHAEMIC AND REMODELLING PROCESSES BAYER HEALTHCARE AG (DE) 2004-03-25 WO disclosed