SCHEMBL29951667

SCHEMBL29951667

Nc1cnc(C=O)cc1OC1CC1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30
FEN1 P39748 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
SCHEMBL29950803 0.89 POLB (0.37) POLBMKNK1MKNK2PDE4APDE4B
SCHEMBL29956175 0.83 POLB (0.36) POLBMKNK1MKNK2
SCHEMBL29954303 0.80 POLB (0.36) POLB
SCHEMBL29951714 0.80 MKNK1 (0.44) MKNK1MKNK2PDE4APDE4BPDE4C
SCHEMBL29955165 0.77 KMO (0.36) POLBMKNK1MKNK2PDE4APDE4B
SCHEMBL29957238 0.77 POLB (0.36) POLB
SCHEMBL29957106 0.76 MKNK1 (0.43) POLBMKNK1MKNK2PDE4APDE4B
SCHEMBL29953060 0.75 POLB (0.37) POLB
SCHEMBL25213581 0.75 FEN1 (0.36) PDE4APDE4BPDE4CPDE4DFEN1
SCHEMBL22804596 0.75 RIPK2 (0.34) FEN1

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