SCHEMBL29951528

SCHEMBL29951528

NCc1cnc(C=O)c(OC2CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
CSNK2A1 P68400 2/20 0.38
LOX P28300 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38
IKBKB O14920 2/20 0.33
CHUK O15111 2/20 0.33
LCK P06239 1/20 0.33
ROCK1 Q13464 1/20 0.33
SCD O00767 1/20 0.32
IRAK4 Q9NWZ3 2/20 0.31

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
SCHEMBL29953815 0.80 POLB (0.39) POLB
SCHEMBL29953293 0.75 MAP4K4 (0.42) POLBIRAK4
SCHEMBL29958512 0.75 HCAR3 (0.40) POLBSCD
SCHEMBL29956175 0.73 POLB (0.36) POLBCSNK2A1LOXLOXL2
SCHEMBL29953531 0.73 POLB (0.34) POLBLOXLOXL2
SCHEMBL29955617 0.73 POLB (0.39) POLBSCD
SCHEMBL29951171 0.73 CSNK2A1 (0.50) POLBCSNK2A1LOXLOXL2IKBKB
SCHEMBL30531824 0.72 POLB (0.49) POLB
SCHEMBL29957202 0.72 POLB (0.37) POLBCSNK2A1LOXLOXL2
SCHEMBL29955920 0.70 CSNK2A1 (0.54) POLBCSNK2A1LOXLOXL2IKBKB

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