SCHEMBL9013191

SCHEMBL9013191

CCCCCNc1ccc(-c2ccccc2)n(CC(=O)NCC(C(C)(C)O)C(F)(F)F)c1=O

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 0.50
CTRC Q99895 1/20 0.40

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
SCHEMBL9013198 0.82 ELANE (0.49) ELANE
SCHEMBL9013195 0.79 ELANE (0.59) ELANECTRC
SCHEMBL7294148 0.77 ELANE (0.51) ELANECTRC
SCHEMBL7294674 0.75 ELANE (0.52) ELANECTRC
SCHEMBL7294687 0.75 ELANE (0.48) ELANECTRC
SCHEMBL7447281 0.67 ELANE (1.00) ELANECTRC
SCHEMBL7440632 0.66 ELANE (0.80) ELANECTRC
SCHEMBL7447258 0.66 ELANE (0.51) ELANE
SCHEMBL7436681 0.64 ELANE (0.82) ELANECTRC
SCHEMBL7444071 0.62 ELANE (0.83) ELANECTRC

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