SCHEMBL6182401

SCHEMBL6182401

COCCOc1cc2ncc(C#N)c(Cl)c2cc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRC P12931 12/20 0.54
EGFR P00533 4/20 0.52
ERBB2 P04626 2/20 0.52
KDR P35968 3/20 0.52
ABL1 P00519 1/20 0.52
FLT1 P17948 1/20 0.52
SYK P43405 1/20 0.52
MAP2K1 Q02750 3/20 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

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
SCHEMBL15263519 0.90 SRC (0.61) SRCEGFRERBB2KDRABL1
SCHEMBL1893875 0.90 SRC (0.61) SRCEGFRERBB2KDRABL1
SCHEMBL6183895 0.87 EGFR (0.52) SRCEGFRERBB2KDRABL1
SCHEMBL4741681 0.85 SRC (0.66) SRCEGFRERBB2KDRABL1
SCHEMBL6182538 0.83 SRC (0.56) SRCEGFRERBB2KDRABL1
SCHEMBL5253488 0.83 SRC (0.54) SRCEGFRERBB2KDRMAP2K1
SCHEMBL6185302 0.82 EGFR (0.46) SRCEGFRERBB2KDRMAP2K1
SCHEMBL5468086 0.82 SRC (0.62) SRCEGFRERBB2KDRABL1
SCHEMBL16543975 0.81 EGFR (0.45) SRCEGFRERBB2KDRMAP2K1
SCHEMBL14116919 0.81 MAP2K1 (0.57) SRCEGFRERBB2KDRABL1

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 SRC 386/4885EGFR 1394/4885ERBB2 395/4885

“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.