SCHEMBL29638698

SCHEMBL29638698

Cc1nn(C(C)c2nn(-c3ccccc3C#N)c3cc(Cl)ccc23)c2ncnc(N)c12

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 20/20 0.73
▸ PIK3CB P42338 8/20 0.67
▸ PIK3CG P48736 4/20 0.67
▸ PIK3CA P42336 4/20 0.63

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
SCHEMBL29638755 0.87 PIK3CD (0.77) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29638685 0.84 PIK3CD (0.74) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29908152 0.84 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29042088 0.84 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29638705 0.83 PIK3CD (0.74) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29042129 0.82 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29638736 0.82 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29638677 0.81 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29042080 0.81 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29042163 0.81 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CA

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
CN-114591335-A Indazole compound and preparation method and application thereof 浙江大学 2022-06-07 — — CN disclosed
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