SCHEMBL29138797

SCHEMBL29138797

O=CN1CCOC[C@@H]1c1ccc(OC(F)F)nn1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 1/20 0.30
MTOR P42345 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
SCHEMBL29138856 0.82 HCRTR1 (0.33) PIK3CAMTOR
SCHEMBL29138812 0.82 HCRTR1 (0.33) PIK3CDPIK3CAPIK3CBMTOR
SCHEMBL29138817 0.82 HCRTR1 (0.33) PIK3CDPIK3CAPIK3CBMTOR
SCHEMBL29138887 0.81 SMN1; SMN2 (0.38) MTOR
SCHEMBL29138874 0.81 SMN1; SMN2 (0.38) MTOR
SCHEMBL29651014 0.77
SCHEMBL29138795 0.77 ATM (0.31) PIK3CAMTOR
SCHEMBL29138847 0.75 ALDH1A1 (0.39)
SCHEMBL29138888 0.75 ALDH1A1 (0.39)
SCHEMBL29138900 0.71 HIF1A (0.39) PIK3CAMTOR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116888120-A PRMTS inhibitors 美国安进公司 2023-10-13 CN claimed
CN-116888120-A PRMTS inhibitors 美国安进公司 2023-10-13 CN disclosed