SCHEMBL48821

SCHEMBL48821

Cc1nc(NC(=O)Nc2ccc(N3CCOCC3)nc2)sc1-c1ccc(Cl)c(S(C)(=O)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 8/20 0.49
PIK3CD O00329 7/20 0.49
PIK3C3 Q8NEB9 3/20 0.49
PIK3CA P42336 3/20 0.49
PIK3CB P42338 3/20 0.49
DGAT1 O75907 2/20 0.47
MTOR P42345 4/20 0.46
PI4KB Q9UBF8 2/20 0.46
RAB9A P51151 1/20 0.45
PPARG P37231 1/20 0.44
PIK3C2A O00443 1/20 0.44
PIK3C2B O00750 1/20 0.44
PI4KA P42356 1/20 0.44
PRKDC P78527 1/20 0.44
MAPT P10636 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL48786 0.81 PIK3CD (0.54) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL5322864 0.80 PIK3CD (0.68) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL49279 0.78 PIK3CG (0.56) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL48667 0.78 PIK3CD (0.60) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL49041 0.76 PIK3CD (0.66) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL48531 0.75 PIK3CD (0.56) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL48392 0.74 PIK3CG (0.83) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL48940 0.74 PIK3CD (0.60) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL49024 0.74 PIK3CG (0.61) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB
SCHEMBL48812 0.74 PIK3CD (0.60) PIK3CGPIK3CDPIK3C3PIK3CAPIK3CB

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 10 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
EP-2311818-B1 Combination of a 5-phenylthiazole compound as PI3 kinase inhibitor with an antiinflammatory, bronchodilatory or antihistamine drug NOVARTIS AG (CH) 2013-01-16 EP disclosed
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
EP-2311818-A1 Combination of a 5-phenylthiazole compound as PI3 kinase inhibitor with an antiinflammatory, bronchodilatory or antihistamine drug Novartis AG (CH) 2011-04-20 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
US-20050119320-A1 5-phenylthiazole derivatives and use as pi3 kinase inhibitors NOVARTIS AG (CH) 2005-06-02 US disclosed
EP-1480962-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS Novartis AG (CH) 2004-12-01 EP disclosed
WO-2003072557-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS NOVARTIS AG (CH) 2003-09-04 WO 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 (2 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 PIK3CG 8/4885PIK3CD 4/4885PIK3C3 27/4885
US-20050119320-A1 5-phenylthiazole derivatives and use as pi3 kinase inhibitors PIK3CA, PIK3R5, PIP5K1B PIK3CG 8/4885PIK3CD 4/4885PIK3C3 27/4885

“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.