SCHEMBL30792173

SCHEMBL30792173

CCCCCCC(=O)Nc1nc(C)c(-c2ccc(OC)c(S(=O)(=O)NCCNC(=O)OC(C)(C)C)c2)s1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 15/20 0.60
PIK3CD O00329 3/20 0.59
PIK3CG P48736 2/20 0.59
PIK3C2G O75747 2/20 0.51
PIK3CA P42336 1/20 0.49
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
CFTR P13569 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL30792221 0.99 PI4KB (0.61) PI4KBPIK3CDPIK3CGPIK3C2GPIK3CA
SCHEMBL29180129 0.89 PIK3CD (0.61) PI4KBPIK3CDPIK3CGPIK3C2GPIK3CA
SCHEMBL29180114 0.89 PI4KB (0.62) PI4KBPIK3CDPIK3CGPIK3C2GPIK3CA
SCHEMBL29180145 0.87 PI4KB (0.52) PI4KBPIK3CDPIK3CGPIK3C2GMEN1
SCHEMBL29265081 0.84 PIK3CD (0.66) PI4KBPIK3CDPIK3CGPIK3C2GPIK3CA
SCHEMBL29180153 0.84 PI4KB (0.53) PI4KBPIK3CDPIK3CGPIK3C2G
SCHEMBL29180143 0.84 PI4KB (0.55) PI4KBPIK3CDPIK3CGPIK3C2G
SCHEMBL29180128 0.83 PI4KB (0.56) PI4KBPIK3CDPIK3CGPIK3C2G
SCHEMBL30792220 0.82 PI4KB (0.60) PI4KBPIK3CDPIK3CGMEN1GAA
SCHEMBL29180148 0.81 PI4KB (0.51) PI4KBPIK3CDPIK3C2GMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117534631-B Phenylthiazole amine PI4KIII beta inhibitor, preparation method, pharmaceutical composition and application thereof 南京市鸿舜医药科技有限公司 2024-04-05 CN claimed
CN-117534631-A Phenylthiazole amine PI4KIII beta inhibitor, preparation method, pharmaceutical composition and application thereof 南京市鸿舜医药科技有限公司 2024-02-09 CN claimed
CN-117534631-B Phenylthiazole amine PI4KIII beta inhibitor, preparation method, pharmaceutical composition and application thereof 南京市鸿舜医药科技有限公司 2024-04-05 CN disclosed
CN-117534631-A Phenylthiazole amine PI4KIII beta inhibitor, preparation method, pharmaceutical composition and application thereof 南京市鸿舜医药科技有限公司 2024-02-09 CN disclosed