SCHEMBL25974606

SCHEMBL25974606

O=C1C[C@@H]2COCCN2C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 8/20 0.39
MTOR P42345 8/20 0.39
PIK3C3 Q8NEB9 7/20 0.35
NR3C2 P08235 2/20 0.33
RPTOR Q8N122 7/20 0.32
MLST8 Q9BVC4 7/20 0.32
RICTOR Q6R327 5/20 0.32
MAPKAP1 Q9BPZ7 5/20 0.32
PIK3CD O00329 1/20 0.31
PIK3R1 P27986 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
CRBN Q96SW2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL25342561 1.00 PIK3CA (0.39) PIK3CAMTORPIK3C3NR3C2RPTOR
Oxalic Acid SCHEMBL31533513 0.92 PIK3CA (0.41) PIK3CAMTORPIK3C3NR3C2
SCHEMBL11540063 0.76
SCHEMBL17925825 0.73 PIK3C3 (0.36) PIK3C3
SCHEMBL23654732 0.71 PIK3CA (0.41) PIK3CAMTORPIK3C3NR3C2RPTOR
SCHEMBL18989221 0.71 PIK3CA (0.39) PIK3CAMTORPIK3C3NR3C2RPTOR
SCHEMBL19016597 0.71 PIK3CA (0.39) PIK3CAMTORPIK3C3NR3C2RPTOR
SCHEMBL5753755 0.71 MAPT (0.38) CRBNALDH1A1
SCHEMBL25343411 0.71 MAPT (0.38) CRBNALDH1A1
SCHEMBL31436247 0.71 MAPT (0.38) CRBNALDH1A1

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-2023135528-A1 HETEROALICYCLIC DERIVATIVES AND THEIR USE IN THE TREATMENT OF CNS DISORDERS SUVEN LIFE SCIENCES LIMITED (IN) 2023-07-20 WO disclosed