SCHEMBL5256089

SCHEMBL5256089

COc1ccc2c(ccc3c(Cl)c(C#N)cnc32)c1OC

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRC P12931 14/20 0.39
EGFR P00533 4/20 0.38
ERBB2 P04626 3/20 0.38
IMPDH2 P12268 1/20 0.38
IMPDH1 P20839 1/20 0.38
GAK O14976 1/20 0.38
SLC6A3 Q01959 1/20 0.37
ABL1 P00519 1/20 0.37
BCR P11274 1/20 0.37

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
SCHEMBL5254028 0.88 SRC (0.34) SRCEGFRERBB2GAKSLC6A3
SCHEMBL5257203 0.88 SRC (0.35) SRCEGFRERBB2IMPDH2IMPDH1
SCHEMBL5256736 0.84 IMPDH2 (0.48) SRCEGFRERBB2IMPDH2IMPDH1
SCHEMBL19889935 0.83 SRC (0.41) SRCEGFRERBB2IMPDH2IMPDH1
SCHEMBL19877059 0.82 SRC (0.41) SRCEGFRERBB2IMPDH2IMPDH1
SCHEMBL6379684 0.79 SRC (0.50) SRCEGFRERBB2GAKABL1
SCHEMBL6381401 0.79 HPGDS (0.54) SRCEGFRERBB2IMPDH2IMPDH1
SCHEMBL5254965 0.77 SRC (0.67) SRCEGFRERBB2ABL1BCR
SCHEMBL5251670 0.76 SRC (0.66) SRCABL1BCR
SCHEMBL6382093 0.76 SLC6A3 (0.46) SRCEGFRERBB2IMPDH2IMPDH1

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