SCHEMBL4745222

SCHEMBL4745222

COc1cc2ncc(C#N)c(CC#N)c2cc1OC

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 12/20 0.55
EGFR P00533 5/20 0.53
ERBB2 P04626 4/20 0.53
GAK O14976 1/20 0.53
MAP2K1 Q02750 4/20 0.52
ABL1 P00519 1/20 0.50
BCR P11274 1/20 0.50
ENPP1 P22413 1/20 0.49

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
SCHEMBL4743309 0.91 SRC (0.61) SRCEGFRERBB2GAKMAP2K1
SCHEMBL24392117 0.87 SRC (0.56) SRCEGFRERBB2GAKMAP2K1
SCHEMBL14445513 0.86 SRC (0.55) SRCEGFRERBB2GAKMAP2K1
SCHEMBL4743752 0.79 SRC (0.62) SRCEGFRERBB2GAKMAP2K1
SCHEMBL15263585 0.78 SRC (0.59) SRCEGFRERBB2GAKMAP2K1
SCHEMBL5498230 0.78 SRC (0.59) SRCEGFRERBB2GAKMAP2K1
SCHEMBL29590073 0.78 SRC (0.62) SRCEGFRERBB2GAKABL1
SCHEMBL1893090 0.78 SRC (0.62) SRCEGFRERBB2GAKABL1
SCHEMBL15279141 0.78 EGFR (0.62) SRCEGFRERBB2GAKMAP2K1
SCHEMBL30080014 0.78 SRC (0.59) SRCEGFRERBB2GAKMAP2K1

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 5 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
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
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
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 SRC 1453/4885EGFR 3929/4885ERBB2 1069/4885

“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.