SCHEMBL7017167

SCHEMBL7017167

COc1cc(Nc2ccnc3cc(-c4ccc(C=O)s4)ccc23)c(Cl)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 0.58
GAK O14976 1/20 0.41
RIPK2 O43353 1/20 0.41
EGFR P00533 1/20 0.41
NOD1 Q9Y239 1/20 0.41
FYN P06241 2/20 0.40
RAF1 P04049 1/20 0.39
BRAF P15056 1/20 0.39

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
SCHEMBL3232772 0.82 SRC (0.68) SRCEGFRFYN
SCHEMBL7167195 0.80 SRC (0.57) SRCGAKRIPK2EGFRNOD1
SCHEMBL7104720 0.79 SRC (0.72) SRCEGFRFYN
SCHEMBL7690775 0.76 SRC (0.61) SRC
SCHEMBL7148769 0.76 SRC (0.59) SRCEGFRFYN
SCHEMBL7015603 0.75 SRC (0.73) SRCGAKRIPK2EGFRNOD1
SCHEMBL7012160 0.75 SRC (0.73) SRCGAKRIPK2EGFRNOD1
SCHEMBL7095983 0.74 SRC (0.58) SRCEGFRFYN
SCHEMBL3224350 0.74 SRC (0.61) SRCGAKRIPK2EGFRNOD1
SCHEMBL7014373 0.74 SRC (0.67) SRCGAKRIPK2EGFRNOD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268431-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS Wyeth (US) 2003-01-02 EP disclosed
WO-2001072711-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS WYETH (US) 2001-10-04 WO disclosed