SCHEMBL8518849

SCHEMBL8518849

C=CCc1ncoc1C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.33
GLA P06280 1/20 0.32
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL29290254 0.77 GLA (0.37) ADORA2AGLA
SCHEMBL8998740 0.77 GLA (0.37) ADORA2AGLA
SCHEMBL22018447 0.70 GLA (0.36) ADORA2AGLA
SCHEMBL11500330 0.70
SCHEMBL28988139 0.69 ADORA3 (0.34) KDM4E
SCHEMBL11879772 0.67 ADORA2A (0.52) ADORA2AGLAKDM4E
SCHEMBL2139234 0.66
SCHEMBL7083112 0.64 PARP1 (0.47) KDM4E
SCHEMBL8546354 0.64
SCHEMBL28805611 0.63 KDM4E (0.38) KDM4E

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-0612736-B1 Process for the preparation of oxazole derivatives HOFFMANN LA ROCHE (CH) 1999-04-14 EP claimed
EP-0859001-A1 Preparation of oxazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1998-08-19 EP disclosed