SCHEMBL76420

SCHEMBL76420

N#CC1COc2c[c]ccc2O1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.32
LTA4H P09960 2/20 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
SCHEMBL76419 0.93 CD274 (0.34) CD274LTA4H
SCHEMBL6675917 0.78 CHRNB4 (0.39)
SCHEMBL706276 0.78 NISCH (0.44) LTA4H
SCHEMBL3472201 0.75
SCHEMBL14322211 0.75 NISCH (0.32)
SCHEMBL423291 0.75 CHRNB4 (0.31)
SCHEMBL9380529 0.74
SCHEMBL9685921 0.72 CHRNB4 (0.49)
SCHEMBL1717598 0.72 LTA4H (0.43) LTA4H
SCHEMBL25368890 0.71 CA2 (0.45) CD274

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
US-8129160-B2 Method of screening for inhibitors of glutaminyl cyclase activity PROBIODRUG AG (DE) 2012-03-06 US disclosed