SCHEMBL25241283

SCHEMBL25241283

Cc1cc(Nc2cc(Nc3ncc(-c4cnn(C)c4C)cc3N(C)S(C)(=O)=O)ncn2)ncn1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIK3C3 Q8NEB9 1/20 0.34
▸ PIK3CA P42336 2/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ PIK3CB P42338 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ PIK3CG P48736 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ TYK2 P29597 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
SCHEMBL25242170 0.92 TYK2 (0.39) PIK3C3PIK3CATYK2
SCHEMBL25288932 0.90 TYK2 (0.38) PIK3C3PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL25283606 0.88 TYK2 (0.34) PIK3C3PIK3CAPIK3CDPIK3CBMTOR
SCHEMBL25243202 0.87 SLC34A1 (0.35) PIK3C3TYK2
SCHEMBL25240241 0.86 TYK2 (0.34) PIK3C3PIK3CATYK2
SCHEMBL25286994 0.85 TYK2 (0.31) PIK3C3TYK2
SCHEMBL25290634 0.85 TYK2 (0.43) PIK3C3TYK2
SCHEMBL25292435 0.82 PIK3C3 (0.34) PIK3C3PIK3CATYK2
SCHEMBL25242541 0.82 TYK2 (0.42) PIK3C3PIK3CATYK2
SCHEMBL25284264 0.82 MAP4K1 (0.47) PIK3C3TYK2

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
EP-4206196-A1 PYRIMIDINE SUBSTITUTED DERIVATIVES AS TYK2 INHIBITORS Almirall S.A. (ES) 2023-07-05 — — EP claimed
EP-4206196-A1 PYRIMIDINE SUBSTITUTED DERIVATIVES AS TYK2 INHIBITORS Almirall S.A. (ES) 2023-07-05 — — EP disclosed
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