SCHEMBL9011669

SCHEMBL9011669

CC(=O)N(c1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2)n(CC(=O)NC(C(=O)C(F)(F)F)C(C)C)c1=O

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 0.62

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
SCHEMBL7285140 0.90 ELANE (0.65) ELANE
Hydrochloric Acid SCHEMBL9011723 0.88 ELANE (0.68) ELANE
SCHEMBL7283490 0.87 ELANE (0.67) ELANE
SCHEMBL7445358 0.83 ELANE (0.65) ELANE
SCHEMBL7273738 0.83 ELANE (0.65) ELANE
SCHEMBL7276755 0.81 ELANE (0.77) ELANE
SCHEMBL7276963 0.81 ELANE (0.64) ELANE
SCHEMBL9011673 0.80 ELANE (0.83) ELANE
SCHEMBL7440143 0.80 ELANE (0.72) ELANE
SCHEMBL9011690 0.80 ELANE (0.60) 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
US-5521179-A Heterocyclic amides ZENECA LIMITED (GB) 1996-05-28 US disclosed