SCHEMBL4745159

SCHEMBL4745159

COc1cc2ncc3c(N)nc(C4CCCCN4C(=O)OC(C)(C)C)cc3c2cc1OC

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADRA1D P25100 7/20 0.47
▸ ADRA1A P35348 7/20 0.47
▸ ADRA1B P35368 7/20 0.47
▸ PDPK1 O15530 11/20 0.47
▸ EPHA2 P29317 1/20 0.45
▸ KDR P35968 1/20 0.45
▸ EPHB4 P54760 1/20 0.45

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
SCHEMBL4745236 0.97 PDPK1 (0.46) ADRA1DADRA1AADRA1BPDPK1EPHA2
SCHEMBL4744810 0.84 PDPK1 (0.46) ADRA1DADRA1AADRA1BPDPK1
SCHEMBL4745296 0.84 NSD2 (0.48) ADRA1DADRA1AADRA1BPDPK1EPHA2
SCHEMBL4745529 0.83 PDPK1 (0.45) ADRA1DADRA1AADRA1BPDPK1
SCHEMBL4786079 0.73 PDPK1 (0.60) PDPK1
SCHEMBL4741566 0.73 PDPK1 (0.60) PDPK1
SCHEMBL4741563 0.73 PDPK1 (0.60) PDPK1
SCHEMBL4741564 0.73 PDPK1 (0.60) PDPK1
SCHEMBL4891422 0.73 PDPK1 (0.56) PDPK1
SCHEMBL4788528 0.72 PDPK1 (0.53) PDPK1

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 ADRA1D 1221/4885ADRA1A 2256/4885ADRA1B 2734/4885

“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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