SCHEMBL680984

SCHEMBL680984

CC(Nc1ncnc2[nH]cnc12)c1cc2ccccc2nc1-c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 9/20 0.73
PIK3CD O00329 16/20 0.48
PIK3CA P42336 1/20 0.45
PIK3CB P42338 1/20 0.45
PIK3R2 O00459 3/20 0.40
EGFR P00533 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL4174885 0.89 PIK3CD (0.59) PIK3CGPIK3CDPIK3CAPIK3CBEGFR
SCHEMBL4182647 0.89 PIK3CD (0.59) PIK3CGPIK3CDPIK3CAPIK3CBEGFR
SCHEMBL4173756 0.87 PIK3CD (0.61) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL4177529 0.87 PIK3CG (0.56) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R2
SCHEMBL27781218 0.87 PIK3CD (0.61) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL681832 0.87 PIK3CG (0.56) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R2
SCHEMBL20068049 0.86 PIK3CG (0.68) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R2
SCHEMBL4185196 0.86 PIK3CD (0.58) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R2
SCHEMBL4173430 0.86 PIK3CG (0.55) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R2
SCHEMBL20061547 0.86 PIK3CG (0.68) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R2

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
US-9790228-B2 Heterocyclic kinase inhibitors INTELLIKINE LLC (US) 2017-10-17 US disclosed
US-9790228-B2 Heterocyclic kinase inhibitors INTELLIKINE LLC (US) 2017-10-17 US disclosed
EP-2346508-B1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE LLC (US) 2016-08-24 EP disclosed
US-20160168157-A1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE LLC 2016-06-16 US disclosed
US-20160168157-A1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE LLC 2016-06-16 US disclosed
US-9296742-B2 Heterocyclic kinase inhibitors INTELLIKINE LLC (US) 2016-03-29 US disclosed
US-9296742-B2 Heterocyclic kinase inhibitors INTELLIKINE LLC (US) 2016-03-29 US disclosed
US-20140206685-A1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE LLC (US) 2014-07-24 US disclosed
US-20140206685-A1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE LLC (US) 2014-07-24 US disclosed
US-20110281866-A1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE, INC. (US) 2011-11-17 US disclosed
US-20110281866-A1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE, INC. (US) 2011-11-17 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 (3 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-20160168157-A1 HETEROCYCLIC KINASE INHIBITORS MAP3K13, MAP3K3, CDK3 PIK3CG 191/4885PIK3CD 147/4885PIK3CA 48/4885
US-20140206685-A1 HETEROCYCLIC KINASE INHIBITORS MAP3K13, MAP3K3, CDK3 PIK3CG 191/4885PIK3CD 147/4885PIK3CA 48/4885
US-20110281866-A1 HETEROCYCLIC KINASE INHIBITORS MAP3K13, MAP3K3, CDK3 PIK3CG 191/4885PIK3CD 147/4885PIK3CA 48/4885

“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.