SCHEMBL48700

SCHEMBL48700

Cc1nc(NC(=O)Cc2ccncc2)sc1-c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.66
PIK3CA P42336 3/20 0.66
PIK3CG P48736 3/20 0.66
PIK3CB P42338 2/20 0.66
WNT3A P56704 3/20 0.61
PI4KB Q9UBF8 11/20 0.52
RORC P51449 1/20 0.51
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GLS O94925 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL48702 0.88 PIK3CG (0.61) PIK3CDPIK3CAPIK3CGPIK3CBWNT3A
SCHEMBL27597047 0.80 PIK3CA (0.81) PIK3CDPIK3CAPIK3CGPIK3CBMEN1
SCHEMBL48857 0.80 PIK3CG (1.00) PIK3CDPIK3CAPIK3CGPIK3CBPI4KB
SCHEMBL48623 0.77 PIK3CD (0.72) PIK3CDPIK3CAPIK3CGPIK3CBPI4KB
SCHEMBL1725743 0.76 WNT3A (1.00) WNT3AMEN1ALDH1A1KMT2AHSD17B10
SCHEMBL48850 0.76 PIK3CD (0.69) PIK3CDPIK3CAPIK3CGPIK3CBPI4KB
SCHEMBL1784577 0.76 PIK3CD (0.69) PIK3CDPIK3CAPIK3CGPIK3CBPI4KB
SCHEMBL1786172 0.75 PIK3CD (0.65) PIK3CDPIK3CAPIK3CGPIK3CBPI4KB
SCHEMBL48593 0.75 PIK3CD (0.61) PIK3CDPIK3CAPIK3CGPIK3CBALDH1A1
SCHEMBL7846410 0.75 RORC (0.68) PI4KBRORCMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480962-B1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS NOVARTIS AG (CH) 2011-08-24 EP claimed
US-8129541-B2 5-phenylthiazole derivatives and use as PI3 kinase inhibitors NOVARTIS AG (CH) 2012-03-06 US disclosed
EP-1480962-B1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS NOVARTIS AG (CH) 2011-08-24 EP disclosed
US-20100093690-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS BRUCE IAN 2010-04-15 US disclosed
US-7687637-B2 5-phenylthiazole derivatives and use as Pi3 kinase inhibitors NOVARTIS AG (CH) 2010-03-30 US disclosed
CN-100548996-C 5-phenylthiazole derivatives and their use for the preparation of medicaments NOVARTIS AG (CH) 2009-10-14 CN disclosed
CN-1639139-A 5-phenylthiazole derivatives and use as PI3 kinase inhibitors NOVARTIS AG (CH) 2005-07-13 CN 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-20100093690-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS PIK3CA, PIK3R5, PIP5K1B PIK3CD 4/4885PIK3CA 1/4885PIK3CG 8/4885

“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.