SCHEMBL2011726

SCHEMBL2011726

Nc1cnc2cncnc2n1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.38
PIK3CG P48736 1/20 0.37
HSP90AA1 P07900 3/20 0.33
CDK2 P24941 1/20 0.32

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
SCHEMBL2007583 0.83 EGFR (0.38) EGFRPIK3CGHSP90AA1CDK2
SCHEMBL3292267 0.76 PIK3CG (0.47) EGFRPIK3CGHSP90AA1
SCHEMBL316631 0.74 PIK3CG (0.44) EGFRPIK3CG
SCHEMBL2467156 0.74 ALDH1A1 (0.41) EGFRPIK3CGCDK2
SCHEMBL29924424 0.74 PIK3CG (0.37) EGFRPIK3CG
SCHEMBL4389242 0.74 PIK3CG (0.37) EGFRPIK3CG
SCHEMBL30211632 0.74 PIK3CG (0.37) EGFRPIK3CG
SCHEMBL2011723 0.74 PIK3CG (0.37) EGFRPIK3CG
SCHEMBL316630 0.74 PIK3CG (0.37) EGFRPIK3CG
SCHEMBL2629407 0.74 PIK3CG (0.37) EGFRPIK3CG

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102076690-A Protein kinase inhibitors VERTEX PHARMA 2011-05-25 CN claimed
CN-115322209-B Tri-fused ring compounds as DNA-PK inhibitors 湖北理工学院 2023-06-20 CN disclosed
CN-115322209-A Tricyclic compounds as DNA-PK inhibitors 湖北理工学院 2022-11-11 CN disclosed
CN-110511226-A Compound or its salt or solvate, its application and pharmaceutical composition UNIV SOUTHWEST JIAOTONG 2019-11-29 CN disclosed
US-9918934-B2 Linker-based lecithin microemulsion delivery vehicles ACOSTA ZARA EDGAR JOEL (CA) 2018-03-20 US disclosed
EP-2120871-B2 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES ACOSTA-ZARA EDGAR JOEL (CA) 2017-12-20 EP disclosed
EP-2120871-B1 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES ACOSTA-ZARA EDGAR JOEL (CA) 2014-11-26 EP disclosed
CN-101484457-B 4, 5-dihydro- [1,2,4] triazolo [4,3-f ] pteridines as protein kinase PLK1 inhibitors for the treatment of proliferative disorders VERTEX PHARMA 2014-09-03 CN disclosed
US-8394974-B2 Process for producing optically active chromene oxide compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-03-12 US disclosed
US-7964623-B2 Tricyclic benzopyrane compound NISSAN CHEMICAL INDUSTRIES LTD. (JP) 2011-06-21 US disclosed
US-20070049600-A1 PTERIDINONES AS KINASE INHIBITORS WARNER-LAMBERT COMPANY 2007-03-01 US disclosed
US-20070032477-A1 Pteridine derivatives useful for making pharmaceutical compositions 4 AZA BIOSCIENCE NV (BE) 2007-02-08 US disclosed
US-7169778-B2 Pteridinones as kinase inhibitors WARNER-LAMBERT COMPANY (US) 2007-01-30 US disclosed
EP-1732929-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS Nissan Chemical Industries, Ltd. (JP) 2006-12-20 EP disclosed
EP-1673092-A1 HETEROCYCLE-SUBSTITUTED PTERIDINE DERIVATIVES AND THEIR USE IN THERAPY 4 AZA Bioscience nv (BE) 2006-06-28 EP disclosed
WO-2005090357-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-29 WO disclosed
WO-2005039587-A1 HETEROCYCLE-SUBSTITUTED PTERIDINE DERIVATIVES AND THEIR USE IN THERAPY 4 AZA BIOSCIENCE NV (BE) 2005-05-06 WO disclosed
EP-1409487-A1 PTERIDINONES AS KINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-04-21 EP disclosed
US-20030130286-A1 Pteridinones as kinase inhibitors DENNY WILLIAM ALEXANDER (NZ) 2003-07-10 US disclosed
WO-2001019825-A1 PTERIDINONES AS KINASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-03-22 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 (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-20030130286-A1 Pteridinones as kinase inhibitors CCNI, CCNK, CDK2 EGFR 128/4885PIK3CG 135/4885HSP90AA1 3897/4885
US-20070049600-A1 PTERIDINONES AS KINASE INHIBITORS CCNI, CCNK, CDK2 EGFR 70/4885PIK3CG 422/4885HSP90AA1 3794/4885
US-20070032477-A1 Pteridine derivatives useful for making pharmaceutical compositions TPMT, TYMS, TNF EGFR 3866/4885PIK3CG 1315/4885HSP90AA1 4278/4885

“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.