SCHEMBL19688323

SCHEMBL19688323

Cc1c(-c2ccnn2-c2ccc(C#N)cc2CC[N+](C)(C)Cc2ccccc2)n(C(=O)NC2CCCC2)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.42
CETP P11597 1/20 0.33
CTSK P43235 1/20 0.33
CYP2C9 P11712 1/20 0.32

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
Bromide SCHEMBL19639790 0.99 ELANE (0.41) ELANECETPCTSKCYP2C9
Benzene SCHEMBL19639750 0.92 ELANE (0.44) ELANECTSKCYP2C9
SCHEMBL19639804 0.92 ELANE (0.45) ELANECTSK
SCHEMBL19639768 0.92 ELANE (0.44) ELANECTSK
Benzene SCHEMBL19639816 0.91 ELANE (0.45) ELANECYP2C9
SCHEMBL19639796 0.90 ELANE (0.46) ELANE
SCHEMBL19639756 0.89 ELANE (0.41) ELANECETPCTSKCYP2C9
SCHEMBL19639828 0.88 ELANE (0.44) ELANECTSK
SCHEMBL17819289 0.85 ELANE (0.47) ELANECTSK
SCHEMBL17819328 0.85 ELANE (0.46) ELANECTSKCYP2C9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464269-B1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF A HNE RELATED DISEASE CHIESI FARM SPA (IT) 2020-04-01 EP claimed
WO-2017207433-A1 HETETOCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF A DISEASE IN WHICH HNE IS IMPLICATED CHIESI FARMACEUTICI S.P.A. (IT) 2017-12-07 WO disclosed