SCHEMBL31661184

SCHEMBL31661184

COC(=O)C1COc2cc(N3CCN(C(=O)OC(C)(C)C)CC3)ccc21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
LMNA P02545 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GPR119 Q8TDV5 7/20 0.46
ALK Q9UM73 5/20 0.44
PDK2 Q15119 1/20 0.44
NAMPT P43490 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42

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
SCHEMBL31661161 0.83 GPR119 (0.39) MAPTLMNAALDH1A1GPR119SMN1; SMN2
SCHEMBL31661173 0.81 ALDH1A1 (0.42) MAPTLMNAALDH1A1GPR119NAMPT
SCHEMBL20722608 0.77 MAPT (0.48) MAPTLMNAALDH1A1GPR119ALK
SCHEMBL20731008 0.77 MAPT (0.48) MAPTLMNAALDH1A1GPR119ALK
SCHEMBL30061346 0.77 MAPT (0.48) MAPTLMNAALDH1A1GPR119ALK
SCHEMBL3846632 0.76 SCD5 (0.58) MAPTLMNAALDH1A1GPR119PDK2
SCHEMBL31704181 0.75 BACE1 (0.42) MAPTLMNAALDH1A1GPR119
SCHEMBL20722911 0.75 GPR119 (0.47) MAPTLMNAALDH1A1GPR119ALK
SCHEMBL20731006 0.75 GPR119 (0.47) MAPTLMNAALDH1A1GPR119ALK
SCHEMBL30062539 0.75 GPR119 (0.47) MAPTLMNAALDH1A1GPR119ALK

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