SCHEMBL29952747

SCHEMBL29952747

CC(CC#N)N(C)CC=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAOB P27338 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
SCHEMBL29954428 0.80
SCHEMBL26316946 0.78
SCHEMBL24627009 0.70 ALDH1A1 (0.31)
SCHEMBL9461911 0.69
SCHEMBL3937939 0.69
SCHEMBL25914989 0.64 CHRNB2 (0.32)
SCHEMBL27895697 0.64
SCHEMBL21813950 0.64 DPP4 (0.36) MAOB
SCHEMBL21813955 0.64 DPP4 (0.36) MAOB
SCHEMBL11421019 0.64 DPP4 (0.33)

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed