SCHEMBL5258385

SCHEMBL5258385

COc1cc(Nc2c(C#N)cnc3c2ccc2c(OCCN4CCOCC4)c(OC)ccc23)c(C)cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 20/20 0.68
ABL1 P00519 2/20 0.60
EGFR P00533 1/20 0.60
ERBB2 P04626 1/20 0.60
FYN P06241 1/20 0.60
LYN P07948 1/20 0.60
BCR P11274 1/20 0.57

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
SCHEMBL5259188 0.96 SRC (0.65) SRCABL1EGFRERBB2FYN
SCHEMBL5255159 0.95 SRC (0.70) SRCABL1EGFRERBB2FYN
SCHEMBL5255162 0.95 SRC (0.69) SRCABL1EGFRERBB2FYN
SCHEMBL5252598 0.94 SRC (0.67) SRCABL1EGFRERBB2FYN
SCHEMBL5257281 0.94 SRC (0.70) SRCABL1EGFRERBB2FYN
SCHEMBL5253353 0.92 SRC (0.68) SRCABL1EGFRERBB2FYN
SCHEMBL5255691 0.90 SRC (0.70) SRCABL1EGFRERBB2FYN
SCHEMBL5254690 0.89 SRC (0.69) SRCABL1EGFRERBB2FYN
SCHEMBL5256421 0.89 SRC (0.72) SRCABL1EGFRERBB2FYN
SCHEMBL5258979 0.89 SRC (0.69) SRCABL1EGFRERBB2FYN

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-1242382-B1 TRICYCLIC PROTEIN KINASE INHIBITORS WYETH CORP (US) 2007-02-07 EP claimed