SCHEMBL5253283

SCHEMBL5253283

COc1ccc2c(ccc3c(Nc4ccc(Cl)cc4Cl)c(C#N)cnc32)c1

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 19/20 0.74
ABL1 P00519 2/20 0.61
BCR P11274 2/20 0.61
EGFR P00533 1/20 0.49
ERBB2 P04626 1/20 0.49
PRKCQ Q04759 1/20 0.48

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
SCHEMBL5253281 0.86 SRC (0.81) SRCABL1BCREGFRERBB2
SCHEMBL5251689 0.86 SRC (0.81) SRCABL1BCREGFRERBB2
SCHEMBL5254975 0.85 SRC (0.56) SRCABL1BCREGFRERBB2
SCHEMBL5254965 0.82 SRC (0.67) SRCABL1BCREGFRERBB2
SCHEMBL5253791 0.82 SRC (0.67) SRCABL1BCREGFRERBB2
SCHEMBL5256325 0.78 SRC (0.45) SRCABL1BCR
SCHEMBL5258438 0.77 SRC (0.59) SRCABL1BCREGFRERBB2
SCHEMBL6185291 0.77 SRC (0.70) SRCABL1BCRPRKCQ
SCHEMBL5254056 0.76 SRC (0.55) SRCABL1BCREGFRERBB2
SCHEMBL5198196 0.76 SRC (1.00) SRCABL1BCREGFRERBB2

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