SCHEMBL31661176

SCHEMBL31661176

CCOC(=O)c1coc2cc(N3CCN(C(=O)OC(C)(C)C)CC3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
HTT P42858 2/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 3/20 0.45
ALDH1A1 P00352 2/20 0.45
PDK2 Q15119 2/20 0.45
GAA P10253 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP2C19 P33261 1/20 0.43
GPR119 Q8TDV5 3/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL31661198 0.85 MAPT (0.42) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL15146763 0.80 MAPT (0.51) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL15140820 0.80 MAPT (0.51) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL8353977 0.80 MAPT (0.51) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL7235368 0.80 MAPT (0.63) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL21430903 0.80 MAPT (0.51) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL31661208 0.80 MAPT (0.49) MAPTHTTLMNAALDH1A1GAA
SCHEMBL28718593 0.79 MAPT (0.43) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL29433673 0.79 MAPT (0.43) MAPTHTTMAPK1LMNAALDH1A1
SCHEMBL31661170 0.78 NAMPT (0.45)

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-2025151602-A1 HETEROARYL COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK4 BRISTOL-MYERS SQUIBB COMPANY (US) 2025-07-17 WO disclosed