SCHEMBL4744771

SCHEMBL4744771

COCCOc1cc2ncc3c(N)nc(N4CCOCC4)cc3c2cc1OC

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 14/20 0.83
KDM1A O60341 1/20 0.54
KDR P35968 1/20 0.48
PDE10A Q9Y233 1/20 0.46
EHMT2 Q96KQ7 1/20 0.44
EHMT1 Q9H9B1 1/20 0.44

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
SCHEMBL4890843 0.91 PDPK1 (1.00) PDPK1KDR
SCHEMBL4888580 0.87 PDPK1 (0.84) PDPK1KDM1A
SCHEMBL4741553 0.87 PDPK1 (1.00) PDPK1
SCHEMBL4747105 0.83 PDPK1 (0.59) PDPK1KDM1AKDR
SCHEMBL4744460 0.83 PDPK1 (0.80) PDPK1KDM1A
SCHEMBL4899329 0.82 PDPK1 (0.76) PDPK1EHMT2EHMT1
SCHEMBL4894801 0.81 PDPK1 (0.70) PDPK1
SCHEMBL29644973 0.80 PDPK1 (1.00) PDPK1KDR
SCHEMBL4785549 0.80 PDPK1 (1.00) PDPK1
SCHEMBL4788522 0.80 PDPK1 (1.00) PDPK1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof WYETH (US) 2008-11-27 US disclosed
WO-2008109613-A1 BENZO[C][2,7]NAPHTHYRIDINE DERIVATIVES, AND THEIR USE AS KINASE INHIBITORS WYETH (US) 2008-09-12 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-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof PDPK1, PDK2, PDK3 PDPK1 1/4885KDM1A 2649/4885KDR 3906/4885

“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.