SCHEMBL2397516

SCHEMBL2397516

Cc1nc(Nc2cnccn2)sc1-c1ccc(S(C)(=O)=O)c(-n2ccnc2)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.45
ADORA2A P29274 2/20 0.45
ADORA1 P30542 2/20 0.45
PIK3CD O00329 14/20 0.41
PIK3CA P42336 14/20 0.41
PIK3CB P42338 12/20 0.41
PIK3CG P48736 11/20 0.41
CLK1 P49759 1/20 0.34
CLK2 P49760 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LCK P06239 1/20 0.34

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
SCHEMBL2396492 0.86 ADORA3 (0.46) ADORA3ADORA2AADORA1PIK3CDPIK3CA
SCHEMBL2398723 0.85 PIK3CD (0.41) PIK3CDPIK3CAPIK3CBPIK3CGCLK1
SCHEMBL2396635 0.84 PIK3CD (0.43) ADORA3ADORA2AADORA1PIK3CDPIK3CA
SCHEMBL2398019 0.83 PIK3CD (0.39) ADORA3ADORA2AADORA1PIK3CDPIK3CA
SCHEMBL2396456 0.83 PIK3CD (0.39) ADORA3ADORA2AADORA1PIK3CDPIK3CA
SCHEMBL48534 0.81 PIK3CG (0.64) PIK3CDPIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL1895171 0.80 ADORA3 (0.52) ADORA3ADORA2AADORA1PIK3CDPIK3CA
Sulfuric Acid SCHEMBL17203250 0.80 PIK3CG (0.62) PIK3CDPIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL2398905 0.80 PIK3CD (0.63) ADORA3ADORA2AADORA1PIK3CDPIK3CA
SCHEMBL48826 0.79 PIK3CD (0.51) PIK3CDPIK3CAPIK3CBPIK3CGCLK1

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
US-8017608-B2 5-Phenylthiazole derivatives and their use as p13 kinase inhibitors NOVARTIS AG (CH) 2011-09-13 US disclosed
EP-1608647-B1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS NOVARTIS AG (CH) 2008-01-09 EP disclosed
US-20060148822-A1 5-Phenylthiazole derivatives and their use as p13 kinase inhibitors NOVARTIS AG (CH) 2006-07-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060148822-A1 5-Phenylthiazole derivatives and their use as p13 kinase inhibitors MAP3K13, AKT3, MAP3K3 ADORA3 723/4885ADORA2A 2787/4885ADORA1 2079/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.