SCHEMBL1301924

SCHEMBL1301924

COc1ccc(-c2ccc3nc(NC(=O)NCCN(C)C)sc3c2)cn1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 10/20 0.68
PIK3CA P42336 8/20 0.65
ABL1 P00519 9/20 0.62
PIK3CD O00329 2/20 0.53
PIK3CB P42338 2/20 0.53
PIK3R1 P27986 1/20 0.53
MTOR P42345 1/20 0.53
RPTOR Q8N122 1/20 0.53
PIK3R5 Q8WYR1 1/20 0.53
MLST8 Q9BVC4 1/20 0.53
PIP5K1C O60331 1/20 0.51
PI4KA P42356 1/20 0.51
PI4KB Q9UBF8 1/20 0.51
LCK P06239 1/20 0.51

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
SCHEMBL1303127 0.89 PIK3CG (0.72) PIK3CGPIK3CAABL1PIK3CDPIK3CB
SCHEMBL1303763 0.87 PIK3CG (0.75) PIK3CGPIK3CAABL1PIK3CDPIK3CB
SCHEMBL1621705 0.82 PIK3CG (1.00) PIK3CGPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL1303700 0.80 PIK3CG (0.64) PIK3CGPIK3CAABL1MTOR
SCHEMBL13188753 0.78 PIK3CG (0.56) PIK3CGPIK3CAABL1PIK3CDPIK3CB
SCHEMBL1303474 0.78 PIK3CG (0.56) PIK3CGPIK3CAABL1PIK3CDPIK3CB
SCHEMBL1302984 0.78 ABL1 (0.65) PIK3CGPIK3CAABL1LCK
SCHEMBL798733 0.74 PIK3CG (0.61) PIK3CGPIK3CAABL1PIK3CDPIK3CB
SCHEMBL1621895 0.74 PIK3CG (0.80) PIK3CGPIK3CAPIK3CDPIK3CBPI4KA
SCHEMBL13457268 0.71 ABL1 (0.60) PIK3CGPIK3CAABL1LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8053574-B2 Organic compounds NOVARTIS AG (CH) 2011-11-08 US claimed
US-20100197682-A1 Organic Compounds NOVARTIS AG 2010-08-05 US claimed
EP-2178868-A1 BICYCLIC HETEROARYL COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Novartis Ag (CH) 2010-04-28 EP claimed
WO-2009010530-A1 BICYCLIC HETEROARYL COMPOUNDS AND THEIR USE AS KINASE INHIBITORS NOVARTIS AG (CH) 2009-01-22 WO claimed
US-8053574-B2 Organic compounds NOVARTIS AG (CH) 2011-11-08 US disclosed
US-20100197682-A1 Organic Compounds NOVARTIS AG 2010-08-05 US disclosed
EP-2178868-A1 BICYCLIC HETEROARYL COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Novartis Ag (CH) 2010-04-28 EP disclosed
WO-2009010530-A1 BICYCLIC HETEROARYL COMPOUNDS AND THEIR USE AS KINASE INHIBITORS NOVARTIS AG (CH) 2009-01-22 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-20100197682-A1 Organic Compounds PIK3CA, PI4KA, PI4KB PIK3CG 11/4885PIK3CA 1/4885ABL1 220/4885

“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.