SCHEMBL9011690

SCHEMBL9011690

CC(=O)N(c1nnn[nH]1)c1ccc(-c2ccccc2)n(CC(=O)NC(C(=O)C(F)(F)F)C(C)C)c1=O

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 0.60
CTRC Q99895 1/20 0.54

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
SCHEMBL7273738 0.83 ELANE (0.65) ELANE
SCHEMBL7285140 0.83 ELANE (0.65) ELANECTRC
Hydrochloric Acid SCHEMBL9011723 0.82 ELANE (0.68) ELANECTRC
SCHEMBL7283490 0.81 ELANE (0.67) ELANECTRC
SCHEMBL7440143 0.80 ELANE (0.72) ELANECTRC
SCHEMBL9011669 0.80 ELANE (0.62) ELANE
SCHEMBL7276527 0.79 ELANE (0.75) ELANECTRC
SCHEMBL7284029 0.79 ELANE (0.71) ELANECTRC
SCHEMBL7274848 0.78 ELANE (0.65) ELANECTRC
SCHEMBL7284451 0.78 ELANE (0.62) 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