SCHEMBL8366126

SCHEMBL8366126

CS(=O)(=O)CCNCCCCNc1ccc2ncnc(Nc3ccc(S(=O)(=O)c4ccccc4)cc3)c2c1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.79
ERBB2 P04626 12/20 0.79
BRAF P15056 1/20 0.46

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
SCHEMBL8361621 0.98 EGFR (0.76) EGFRERBB2BRAF
SCHEMBL8367350 0.94 EGFR (0.73) EGFRERBB2BRAF
SCHEMBL8367557 0.89 EGFR (0.77) EGFRERBB2BRAF
SCHEMBL8363548 0.88 EGFR (1.00) EGFRERBB2
SCHEMBL8361058 0.88 EGFR (0.75) EGFRERBB2BRAF
SCHEMBL8611220 0.88 EGFR (0.62) EGFRERBB2BRAF
SCHEMBL8364217 0.87 EGFR (0.65) EGFRERBB2
SCHEMBL8367370 0.86 EGFR (0.68) EGFRERBB2
SCHEMBL8613930 0.86 EGFR (0.61) EGFRERBB2BRAF
SCHEMBL8515985 0.86 EGFR (0.72) EGFRERBB2BRAF

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
WO-1999035132-A1 HETEROCYCLIC COMPOUNDS GLAXO GROUP LIMITED (GB) 1999-07-15 WO disclosed