SCHEMBL2328454

SCHEMBL2328454

CC(=O)Nc1nc(C)c(-c2ccc(C(=O)C3CC3)cc2)s1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 14/20 0.72
PIK3CD O00329 11/20 0.72
PIK3CA P42336 11/20 0.72
PIK3CB P42338 11/20 0.72
PI4KB Q9UBF8 6/20 0.48
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
PIK3R1 P27986 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
SCHEMBL48942 0.84 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL48710 0.83 PIK3CG (0.82) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL48461 0.80 PIK3CG (0.76) PIK3CGPIK3CDPIK3CAPIK3CBKDM4E
SCHEMBL2324376 0.79 NPC1 (0.46) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL48393 0.79 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBKDM4E
SCHEMBL12992093 0.78 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBALDH1A1
SCHEMBL2948810 0.78 PIK3CD (0.77) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL10670937 0.77 PIK3CG (0.72) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL2961300 0.77 PIK3CD (0.56) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL48302 0.76 MAPT (0.78) PIK3CGPIK3CDPIK3CAPIK3CBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2357179-A1 Thiazol-2-yl organic compounds Novartis AG (CH) 2011-08-17 EP disclosed
US-7754746-B2 Organic compounds NOVARTIS AG (CH) 2010-07-13 US disclosed
US-7754746-B2 Organic compounds NOVARTIS AG (CH) 2010-07-13 US disclosed
US-7754746-B2 Organic compounds NOVARTIS AG (CH) 2010-07-13 US disclosed
CN-101374823-A Organic compounds NOVARTIS AG (CH) 2009-02-25 CN disclosed
US-20080319033-A1 3-{3-[5-(4-acetylphenyl)-4-methylthiazol-2-yl]-ureido}-N-tert-butylpropionamide, exhibiting phosphatidylinositol 3-kinase inhibitory activity and used for treating respiratory system disorders, such as asthma NOVARTIS AG 2008-12-25 US disclosed
US-20080319033-A1 3-{3-[5-(4-acetylphenyl)-4-methylthiazol-2-yl]-ureido}-N-tert-butylpropionamide, exhibiting phosphatidylinositol 3-kinase inhibitory activity and used for treating respiratory system disorders, such as asthma NOVARTIS AG 2008-12-25 US disclosed
US-20080319033-A1 3-{3-[5-(4-acetylphenyl)-4-methylthiazol-2-yl]-ureido}-N-tert-butylpropionamide, exhibiting phosphatidylinositol 3-kinase inhibitory activity and used for treating respiratory system disorders, such as asthma NOVARTIS AG 2008-12-25 US disclosed
EP-1966175-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2008-09-10 EP disclosed
WO-2007068473-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-06-21 WO disclosed
WO-2007068473-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-06-21 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 (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-20080319033-A1 3-{3-[5-(4-acetylphenyl)-4-methylthiazol-2-yl]-ureido}-N-tert-butylpropionamide, exhibiting phosphatidylinositol 3-kinase inhibitory activity and used for treating respiratory system disorders, such as asthma AKT3, PIK3R3, PIK3CD PIK3CG 10/4885PIK3CD 3/4885PIK3CA 4/4885

“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.