SCHEMBL1303565

SCHEMBL1303565

CCn1nnc(CCNC(=O)Nc2nc3ccc(-c4cccnc4)cn3n2)n1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 18/20 0.60
PIK3CA P42336 12/20 0.60
PIK3CD O00329 14/20 0.49
PIK3CB P42338 10/20 0.49
TTK P33981 1/20 0.47
MTOR P42345 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL1302534 0.87 PIK3CG (0.53) PIK3CGPIK3CAPIK3CDPIK3CBHPGD
SCHEMBL13960257 0.86 PIK3CG (0.52) PIK3CGPIK3CAPIK3CDPIK3CBTTK
SCHEMBL1302602 0.84 MAP3K5 (0.51) PIK3CGPIK3CAPIK3CDPIK3CBHPGD
SCHEMBL1303184 0.84 PIK3CA (0.53) PIK3CGPIK3CAPIK3CD
SCHEMBL12105377 0.84 PIK3CG (0.50) PIK3CGPIK3CAPIK3CDPIK3CBTTK
SCHEMBL1303275 0.84 PIK3CG (0.52) PIK3CGPIK3CAPIK3CDPIK3CBTTK
SCHEMBL1302939 0.83 PIK3CG (0.43) PIK3CGPIK3CAPIK3CDPIK3CBTTK
SCHEMBL1302406 0.77 HPGD (0.40) PIK3CGPIK3CAPIK3CDPIK3CBHPGD
SCHEMBL3090747 0.76 PIK3CG (1.00) PIK3CGPIK3CAPIK3CDPIK3CB
SCHEMBL1302919 0.76 MAP3K5 (0.53) PIK3CGPIK3CAPIK3CD

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-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-8053574-B2 Organic compounds NOVARTIS AG (CH) 2011-11-08 US disclosed
US-20100197682-A1 Organic Compounds NOVARTIS AG 2010-08-05 US disclosed
US-20100197682-A1 Organic Compounds NOVARTIS AG 2010-08-05 US 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 1/4885PIK3CD 9/4885

“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.