SCHEMBL30997404

SCHEMBL30997404

CCCCCNc1nc(C)c(-c2ccc(OC)c(NS(N)(=O)=O)c2)s1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 16/20 0.49
PIK3CD O00329 3/20 0.45
PIK3CG P48736 2/20 0.44
PIK3C2G O75747 1/20 0.43
PIK3CA P42336 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL30792155 0.85 PI4KB (0.59) PI4KBKDM4EMEN1ALDH1A1LMNA
SCHEMBL30997394 0.85 PI4KB (0.59) PI4KBKDM4EMEN1ALDH1A1LMNA
SCHEMBL30997409 0.82 PI4KB (0.62) PI4KBPIK3CDKDM4EMEN1ALDH1A1
SCHEMBL30997422 0.82 PI4KB (0.64) PI4KBPIK3CD
Propionic Acid SCHEMBL29265080 0.81 PIK3CD (0.52) PI4KBPIK3CDPIK3CG
SCHEMBL29265067 0.81 PIK3CD (0.51) PI4KBPIK3CDPIK3CG
SCHEMBL29265061 0.79 PIK3CD (0.50) PI4KBPIK3CDPIK3CG
SCHEMBL29265052 0.79 PIK3CD (0.49) PI4KBPIK3CDPIK3CG
SCHEMBL30997426 0.77 PI4KB (0.61) PI4KBPIK3CDPIK3CGPIK3C2GPIK3CA
SCHEMBL29180148 0.77 PI4KB (0.51) PI4KBPIK3CDPIK3C2GKDM4EMEN1

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-118221610-A Phenylthiazole amine PI4KIII beta/HDAC double-target inhibitor, preparation method, pharmaceutical composition and application thereof 南京市鸿舜医药科技有限公司 2024-06-21 CN claimed
CN-118221610-A Phenylthiazole amine PI4KIII beta/HDAC double-target inhibitor, preparation method, pharmaceutical composition and application thereof 南京市鸿舜医药科技有限公司 2024-06-21 CN disclosed