SCHEMBL4524145

SCHEMBL4524145

CC(=O)Nc1nc(CS(C)(=O)=O)c(-c2cnc(Cl)c(NS(=O)(=O)c3ccccc3)c2)s1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.76
PIK3CA P42336 16/20 0.76
PIK3CB P42338 16/20 0.76
PIK3CG P48736 16/20 0.76
AKT1 P31749 2/20 0.65

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
SCHEMBL4509793 0.90 PIK3CD (0.77) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
SCHEMBL28783397 0.89 PIK3CD (0.75) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
SCHEMBL4517140 0.88 PIK3CD (0.73) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
SCHEMBL924973 0.86 PIK3CB (1.00) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
SCHEMBL4512724 0.84 PIK3CD (0.68) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
SCHEMBL4527351 0.84 PIK3CD (0.67) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
Trifluoroacetic Acid SCHEMBL926036 0.82 PIK3CB (0.90) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
SCHEMBL17881201 0.79 PIK3CD (0.85) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1619927 0.79 AKT1 (1.00) PIK3CDPIK3CAPIK3CBPIK3CGAKT1
SCHEMBL926769 0.78 PIK3CD (0.84) PIK3CDPIK3CAPIK3CBPIK3CG

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-101484452-A Thiazole derivatives and their use as anti-tumour agents ASTRAZENECA AB (SE) 2009-07-15 CN disclosed
US-20090076009-A1 THIAZOLE DERIVATIVES AND THEIR USE AS ANTI-TUMOUR AGENTS ASTRAZENECA AB (SE) 2009-03-19 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-20090076009-A1 THIAZOLE DERIVATIVES AND THEIR USE AS ANTI-TUMOUR AGENTS MTOR, RPTOR, JAK2 PIK3CD 31/4885PIK3CA 13/4885PIK3CB 67/4885

“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.