SCHEMBL6183895

SCHEMBL6183895

COCCOc1cc2ncc(C#N)c(O)c2cc1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.52
ERBB2 P04626 3/20 0.52
SRC P12931 8/20 0.52
KDR P35968 3/20 0.52
FLT1 P17948 2/20 0.52
ABL1 P00519 1/20 0.52
SYK P43405 1/20 0.52
MAP2K1 Q02750 4/20 0.47
PDGFRB P09619 1/20 0.44
KIT P10721 1/20 0.44
PDGFRA P16234 1/20 0.44
KDM1A O60341 1/20 0.43
FGFR1 P11362 1/20 0.42

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
SCHEMBL15265722 0.90 EGFR (0.61) EGFRERBB2SRCKDRFLT1
SCHEMBL1893862 0.90 EGFR (0.61) EGFRERBB2SRCKDRFLT1
SCHEMBL6182401 0.87 SRC (0.54) EGFRERBB2SRCKDRFLT1
SCHEMBL4786042 0.85 SRC (0.63) EGFRERBB2SRCKDRFLT1
SCHEMBL6185004 0.82 EGFR (0.46) EGFRERBB2SRCKDRMAP2K1
SCHEMBL16543980 0.82 EGFR (0.46) EGFRERBB2SRCKDRMAP2K1
SCHEMBL22589792 0.80 SRC (0.56) EGFRERBB2SRCKDRFLT1
SCHEMBL29363297 0.80 SRC (0.56) EGFRERBB2SRCKDRFLT1
SCHEMBL4742038 0.78 EGFR (0.62) EGFRERBB2SRCKDRFLT1
SCHEMBL4742854 0.78 EGFR (0.62) EGFRERBB2SRCKDRFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100354263-C Process for the preparation of 7-substituted-3-quinoline and 3-quinol-4-one carbonitriles WYETH CORP (US) 2007-12-12 CN disclosed
CN-1665787-A Process for preparing 7-substituted-3-quinolines and 3-quinol-4-one carbonitriles WYETH CORP (US) 2005-09-07 CN disclosed
EP-1499594-B1 PROCESS FOR THE PREPARATION OF 7-SUBSTITUTED-3-QUINOLINE AND 3-QUINOL-4-ONE CARBONITRILES WYETH CORP (US) 2005-08-17 EP disclosed
EP-1499594-A1 PROCESS FOR THE PREPARATION OF 7-SUBSTITUTED-3-QUINOLINE AND 3-QUINOL-4-ONE CARBONITRILES Wyeth Holdings Corporation (US) 2005-01-26 EP disclosed
US-6780996-B2 KINASE INHIBITORS; ANTICANCER AGENTS WYETH HOLDINGS CORPORATION 2004-08-24 US disclosed
US-20030212276-A1 Process for the preparation of 7-substituted-3 quinolinecarbonitriles WYETH HOLDINGS CORPORATION 2003-11-13 US disclosed
WO-2003093241-A1 PROCESS FOR THE PREPARATION OF 7-SUBSTITUTED-3-QUINOLINE AND 3-QUINOL-4-ONE CARBONITRILES WYETH HOLDINGS CORPORATION (US) 2003-11-13 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-20030212276-A1 Process for the preparation of 7-substituted-3 quinolinecarbonitriles MAP4K2, MAP3K7, MAP4K1 EGFR 1394/4885ERBB2 395/4885SRC 386/4885

“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.