SCHEMBL7148769

SCHEMBL7148769

COc1cc(Nc2ccnc3cc(-c4ccc(CCCCN5CCOCC5)s4)ccc23)c(Cl)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 20/20 0.59
EGFR P00533 1/20 0.48
FYN P06241 1/20 0.48
MAP2K1 Q02750 1/20 0.48
ABL1 P00519 1/20 0.47
BCR P11274 1/20 0.47

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
SCHEMBL7104720 0.90 SRC (0.72) SRCEGFRFYNMAP2K1
SCHEMBL3224058 0.85 SRC (0.83) SRCEGFRFYNMAP2K1ABL1
SCHEMBL7095983 0.82 SRC (0.58) SRCEGFRFYNMAP2K1
SCHEMBL7014324 0.81 APP (0.47) SRC
SCHEMBL7249493 0.78 SRC (0.59) SRCEGFRFYNMAP2K1ABL1
SCHEMBL7097985 0.78 SRC (0.73) SRCEGFRFYNMAP2K1
SCHEMBL7148997 0.78 SRC (0.73) SRCEGFRFYNMAP2K1
SCHEMBL7017167 0.76 SRC (0.58) SRCEGFRFYN
SCHEMBL3216225 0.75 SRC (1.00) SRCEGFRFYNMAP2K1
SCHEMBL19610566 0.71 SRC (0.70) SRCEGFRFYNMAP2K1ABL1

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