SCHEMBL6184586

SCHEMBL6184586

COCCOc1ccc2c(Nc3cc(OC)ccc3C)c(C#N)cnc2c1OC

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 17/20 0.52
ABL1 P00519 3/20 0.49
ABL2 P42684 1/20 0.49
BCR P11274 2/20 0.47
EGFR P00533 2/20 0.42
ERBB2 P04626 2/20 0.42
MAP2K1 Q02750 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
SCHEMBL6184673 0.90 SRC (0.60) SRCABL1ABL2BCR
SCHEMBL6186132 0.89 SRC (0.59) SRCABL1ABL2EGFRERBB2
SCHEMBL6188022 0.86 SRC (0.49) SRCABL1ABL2EGFRERBB2
SCHEMBL6183294 0.84 SRC (0.63) SRCABL1ABL2BCR
SCHEMBL6188532 0.83 SRC (0.73) SRCABL1ABL2BCR
SCHEMBL6384502 0.82 SRC (0.53) SRCABL1ABL2BCREGFR
SCHEMBL6183910 0.82 SRC (0.70) SRCABL1ABL2BCREGFR
SCHEMBL6185071 0.82 SRC (0.71) SRCEGFRERBB2
SCHEMBL6186103 0.81 SRC (0.70) SRCABL1BCR
SCHEMBL6185291 0.81 SRC (0.70) SRCABL1ABL2BCR

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
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 claimed