SCHEMBL30584309

SCHEMBL30584309

Cc1cc([C@@H](C)Nc2cccnc2-c2ccccc2F)c2oc(-c3cccnc3)cc(=O)c2c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 16/20 0.54
▸ PIK3CB P42338 2/20 0.54
▸ PIK3CD O00329 1/20 0.54
▸ PIK3CG P48736 1/20 0.54
▸ CYP1A1 P04798 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CYP1B1 Q16678 2/20 0.41
▸ PRKDC P78527 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MTOR P42345 1/20 0.40
▸ PIK3C3 Q8NEB9 1/20 0.40

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
SCHEMBL26662590 1.00 PIK3CA (0.54) PIK3CAPIK3CBPIK3CDPIK3CGCYP1A1
SCHEMBL26662582 1.00 PIK3CA (0.54) PIK3CAPIK3CBPIK3CDPIK3CGCYP1A1
SCHEMBL30742239 0.86 PIK3CA (0.44) PIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL27129685 0.86 PIK3CA (0.44) PIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL26871116 0.86 PIK3CA (0.44) PIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL26662608 0.85 PIK3CA (0.40) PIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL26662604 0.85 PIK3CA (0.40) PIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL30584382 0.85 PIK3CA (0.40) PIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL30584279 0.85 PIK3CA (0.57) PIK3CAPIK3CBPIK3CDPIK3CGCYP1A1
SCHEMBL26662600 0.85 PIK3CA (0.57) PIK3CAPIK3CBPIK3CDPIK3CGCYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4514784-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE Petra Pharma Corporation (US) 2025-03-05 — — EP disclosed
CN-119301106-A Allosteric benzopyrone inhibitors of phosphoinositide 3-kinase (PI 3K) for the treatment of disease 佩特拉制药公司 2025-01-10 — — CN disclosed
WO-2023212693-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PETRA PHARMA CORPORATION (US) 2023-11-02 — — WO disclosed
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