SCHEMBL8214835

SCHEMBL8214835

Nc1ncnc2nc(-c3cccnc3C3CNCCO3)cc(C3CCCC3)c12

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.46
▸ IKBKB O14920 6/20 0.36
▸ CHUK O15111 1/20 0.36
▸ EGFR P00533 1/20 0.32
▸ SRC P12931 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
SCHEMBL8215361 0.99 ADK (0.47) ADKIKBKBCHUKEGFRSRC
SCHEMBL8162214 0.94 ADK (0.39) ADKIKBKBCHUK
SCHEMBL8215356 0.85 PI4KA (0.36) ADK
SCHEMBL8147918 0.83 KDM4E (0.35) ADK
SCHEMBL8148533 0.83 IKBKB (0.32) IKBKBCHUK
SCHEMBL2035227 0.82 ADK (0.41) ADK
SCHEMBL8265827 0.82 HPGD (0.52) ADK
SCHEMBL2034210 0.82 ADK (0.48) ADK
SCHEMBL8248612 0.82 PTPN11 (0.34) —
SCHEMBL8267956 0.81 HPGD (0.43) ADK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 — — WO claimed
US-20130023491-A1 BETA-CELL REPLICATION PROMOTING COMPOUNDS AND METHODS OF THEIR USE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-01-24 — — US disclosed
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 — — 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-20130023491-A1 BETA-CELL REPLICATION PROMOTING COMPOUNDS AND METHODS OF THEIR USE ADK, AHCY, IAPP ADK 1/4885IKBKB 542/4885CHUK 328/4885

“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.

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