SCHEMBL4745294

SCHEMBL4745294

COC(=O)c1cncc(Oc2cccc(NC(=O)OC(C)(C)C)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
GRM5 P41594 13/20 0.47
CYP3A4 P08684 1/20 0.40

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
SCHEMBL4743579 0.78 ATM (0.44) GRM5
SCHEMBL28997343 0.76 SORT1 (0.48) GRM5
SCHEMBL4745642 0.75 ATM (0.42) GRM5
SCHEMBL29394473 0.73 LCK (0.47)
SCHEMBL1857045 0.72 ALDH1A1 (0.48) GRM5CYP3A4
SCHEMBL31145167 0.72 ATM (0.51)
SCHEMBL7822474 0.72 ATM (0.51)
SCHEMBL4741655 0.72 LMNA (0.42) L3MBTL1GRM5
SCHEMBL4741552 0.72 ATM (0.38) CYP3A4
SCHEMBL3427901 0.71 MAPK8 (0.47)

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 L3MBTL1 3826/4885GRM5 4351/4885CYP3A4 2962/4885

“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.