SCHEMBL6596758

SCHEMBL6596758

Cc1cccc2nc(N(CC(=O)OC(C)(C)C)c3ccccc3)oc(=O)c12

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.48
CTRB1 P17538 2/20 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
SCHEMBL6496179 0.86 ELANE (0.55) ELANECTRB1
SCHEMBL10362710 0.77 ELANE (0.54) ELANE
SCHEMBL6500227 0.75 CTRB1 (0.59) ELANECTRB1
SCHEMBL10363017 0.74 ELANE (0.54) ELANE
SCHEMBL28184171 0.73 GSTO1 (0.44)
SCHEMBL10362993 0.69 ELANE (0.64) ELANECTRB1
SCHEMBL9398123 0.69 ELANE (0.56) ELANECTRB1
SCHEMBL6496738 0.69 ELANE (0.59) ELANECTRB1
SCHEMBL6498466 0.69 ELANE (0.76) ELANE
SCHEMBL9567432 0.68 ELANE (0.45) ELANECTRB1

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-1122245-B1 2-Amino-benzoxazinones for the treatment of viral infections SEARLE & CO (US) 2004-07-07 EP claimed