SCHEMBL21850201

SCHEMBL21850201

CC(O)CN/C=C(\C=N)[N+](=O)[O-]

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 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
SCHEMBL20460999 0.75 ADH1B (0.35)
SCHEMBL21850198 0.74 ALDH1A1 (0.36) MAPT
SCHEMBL20053920 0.74 ALDH1A1 (0.30)
SCHEMBL22060817 0.74
SCHEMBL22061464 0.72
SCHEMBL22162200 0.71 MAPT (0.30) MAPT
SCHEMBL5026870 0.71
SCHEMBL24884479 0.69 MAPT (0.32) MAPT
SCHEMBL24562795 0.67 CA12 (0.31)
SCHEMBL22272085 0.63 ADH1B (0.34)

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-3099695-B1 COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-04-08 EP disclosed