SCHEMBL7210360

SCHEMBL7210360

NC(=O)C[C@@H](C=O)NC(=O)Cn1c(-c2cccs2)ncc(NC(=O)OCc2ccccc2)c1=O

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ELANE P08246 20/20 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
SCHEMBL7208083 0.94 ELANE (0.68) ELANE
SCHEMBL7863330 0.84 ELANE (0.70) ELANE
SCHEMBL6556446 0.83 ELANE (0.69) ELANE
SCHEMBL6557614 0.81 ELANE (0.62) ELANE
SCHEMBL6556086 0.80 ELANE (0.80) ELANE
SCHEMBL6558297 0.80 ELANE (0.73) ELANE
SCHEMBL9584142 0.80 ELANE (1.00) ELANE
SCHEMBL9584587 0.80 ELANE (0.79) ELANE
SCHEMBL8762836 0.77 ELANE (0.75) ELANE
SCHEMBL7296453 0.77 ELANE (0.64) 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
EP-0752987-B1 PYRIMIDINYL DERIVATIVES AS INTERLEUKIN INHIBITORS VERTEX PHARMA (US) 2003-11-12 EP claimed