SCHEMBL3685308

SCHEMBL3685308

CCn1nnc(CCNC(=O)Nc2cn3nc(-c4cncc(C#N)c4)ccc3n2)n1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 5/20 0.44
CSNK1E P49674 5/20 0.44
RIPK1 Q13546 10/20 0.44
PIK3CA P42336 5/20 0.44
PIK3CD O00329 2/20 0.44
PIK3CG P48736 2/20 0.44
PIK3CB P42338 1/20 0.39
CLK1 P49759 1/20 0.39
CLK2 P49760 1/20 0.39
PI4KB Q9UBF8 1/20 0.39

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
SCHEMBL1302522 0.89 PIK3CA (0.49) CSNK1DCSNK1ERIPK1PIK3CAPIK3CD
SCHEMBL13960432 0.88 PIK3CA (0.47) RIPK1PIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL3690331 0.86 PIK3CA (0.37) CSNK1DCSNK1EPIK3CAPIK3CDPIK3CG
SCHEMBL1303677 0.86 RIPK1 (0.46) RIPK1PIK3CAPIK3CDPIK3CG
SCHEMBL1303184 0.85 PIK3CA (0.53) CSNK1DCSNK1ERIPK1PIK3CAPIK3CD
SCHEMBL12105377 0.85 PIK3CG (0.50) PIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL1303674 0.80 CSNK1D (0.46) CSNK1DCSNK1ERIPK1PIK3CAPIK3CD
SCHEMBL1302544 0.79 PIK3CA (0.43) CSNK1DCSNK1ERIPK1PIK3CAPIK3CD
SCHEMBL1304202 0.78 PIK3CA (0.37) CSNK1DCSNK1EPIK3CAPIK3CDPIK3CG
SCHEMBL1303556 0.77 RIPK1 (0.45) RIPK1PIK3CAPIK3CDPIK3CG

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 6 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

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 CSNK1D 638/4885CSNK1E 541/4885RIPK1 427/4885

“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.