SCHEMBL31389554

SCHEMBL31389554

CCOC(=O)c1nc2c(s1)CC(c1ccccc1)CC2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.55
LMNA P02545 2/20 0.55
GAA P10253 2/20 0.55
HSD17B10 Q99714 2/20 0.55
POLB P06746 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
PDK1 Q15118 1/20 0.44
GSK3B P49841 2/20 0.43
CSNK2A1 P68400 2/20 0.43
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CACNA1D Q01668 1/20 0.40
CDC7 O00311 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
DBF4 Q9UBU7 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HSP90AA1 P07900 1/20 0.39

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
SCHEMBL14433681 0.77 MAPT (0.69) MAPTLMNAGAAHSD17B10POLB
SCHEMBL14942591 0.77 PDK1 (0.48) MAPTLMNAGAAHSD17B10TSHR
SCHEMBL31389935 0.76 PDK1 (0.47) MAPTLMNAGAAHSD17B10TSHR
SCHEMBL17621024 0.76 GAA (0.42) MAPTLMNAGAAHSD17B10POLB
SCHEMBL21333625 0.75 MAPT (0.66) MAPTLMNAGAAHSD17B10POLB
SCHEMBL30960184 0.74 LMNA (0.53) MAPTLMNAGAAPOLBMAPK1
SCHEMBL8203493 0.74 KDM4E (0.71) MAPTLMNAGAAHSD17B10POLB
SCHEMBL31389785 0.74 MAPT (0.64) MAPTLMNAGAAHSD17B10POLB
SCHEMBL12922693 0.73 PARP1 (0.53) MAPTLMNAGAAHSD17B10POLB
SCHEMBL8005977 0.73 PARP1 (0.50) MAPTLMNAGAAHSD17B10POLB

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
WO-2025043225-A2 DEGRADERS OF CYCLIN-DEPENDENT KINASE 2 GENENTECH, INC. (US) 2025-02-27 WO disclosed