SCHEMBL8208552

SCHEMBL8208552

CC(C)(C)OC(=O)C(=O)N=C(N)n1cccn1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 9/20 0.43
ELANE P08246 1/20 0.33

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
SCHEMBL16945673 0.85 NOS1 (0.45) NOS1ELANE
SCHEMBL1421922 0.85 NOS1 (0.45) NOS1ELANE
SCHEMBL12446838 0.85 NOS1 (0.45) NOS1ELANE
SCHEMBL7535805 0.77 ELANE (0.39) NOS1ELANE
SCHEMBL8820639 0.74 NOS1 (0.53) NOS1ELANE
SCHEMBL27483325 0.74 NOS1 (0.45) NOS1ELANE
SCHEMBL14936428 0.74 NOS1 (0.49) NOS1ELANE
SCHEMBL15366422 0.73 NOS1 (0.51) NOS1ELANE
SCHEMBL14940665 0.73 NOS1 (0.51) NOS1ELANE
SCHEMBL1206559 0.73 NOS1 (0.44) NOS1ELANE

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
WO-2000078723-A1 PROCESS FOR THE PREPARATION OF BUTOXYCARBONYLIMINO COMPOUNDS AND INTERMEDIATES THEREFOR GLAXO GROUP LIMITED (GB) 2000-12-28 WO disclosed