SCHEMBL7673296

SCHEMBL7673296

COc1cc(Nc2c(C#N)cnc3ccccc23)cc(OC)c1OC

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 16/20 0.74
EGFR P00533 2/20 0.74
GAK O14976 1/20 0.74
POLB P06746 1/20 0.63
RAD52 P43351 1/20 0.63
MAP2K1 Q02750 3/20 0.61
ERBB2 P04626 1/20 0.61
RAF1 P04049 1/20 0.59

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
SCHEMBL4097022 0.85 SRC (0.73) SRCEGFRGAKERBB2
SCHEMBL27537981 0.85 SRC (0.73) SRCEGFRGAKERBB2
SCHEMBL3978612 0.85 SRC (0.73) SRCEGFRGAKERBB2
SCHEMBL5257082 0.85 SRC (0.73) SRCEGFRGAKMAP2K1ERBB2
SCHEMBL5251972 0.82 SRC (0.80) SRCEGFRGAKERBB2
SCHEMBL6185084 0.81 SRC (0.83) SRCEGFRGAKMAP2K1ERBB2
SCHEMBL676613 0.79 MAP2K1 (0.78) EGFRMAP2K1ERBB2RAF1
SCHEMBL29556194 0.79 MAP2K1 (0.78) EGFRMAP2K1ERBB2RAF1
SCHEMBL7018285 0.78 SRC (0.76) SRC
SCHEMBL28756490 0.78 MAP2K1 (0.95) SRCEGFRGAKMAP2K1ERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020026052-A1 3-cyanoquinolines, 3-cyano-1,6-naphthyridines, and 3-cyano-1,7-naphthyridines as protein kinase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2002-02-28 US claimed

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-20020026052-A1 3-cyanoquinolines, 3-cyano-1,6-naphthyridines, and 3-cyano-1,7-naphthyridines as protein kinase inhibitors PKD1, PKD2, CSNK1A1 SRC 237/4885EGFR 527/4885GAK 747/4885

“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.