SCHEMBL7095294

SCHEMBL7095294

CS(=O)(=O)CCCNCC1=CC(=O)C(c2cc3c(Nc4ccc(OCc5ccccc5)cc4)ncnc3cn2)O1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ERBB2 P04626 15/20 0.60
▸ EGFR P00533 13/20 0.60

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
SCHEMBL7099826 0.96 EGFR (0.66) ERBB2EGFR
SCHEMBL5792742 0.89 EGFR (0.62) ERBB2EGFR
SCHEMBL7093321 0.87 ERBB2 (0.51) ERBB2EGFR
SCHEMBL5792777 0.86 EGFR (0.61) ERBB2EGFR
SCHEMBL5796002 0.86 EGFR (0.54) ERBB2EGFR
SCHEMBL5795480 0.86 EGFR (0.61) ERBB2EGFR
SCHEMBL7149274 0.86 ERBB2 (0.60) ERBB2EGFR
SCHEMBL5792052 0.81 EGFR (0.55) ERBB2EGFR
SCHEMBL7009047 0.80 ERBB2 (0.91) ERBB2EGFR
SCHEMBL5793460 0.80 EGFR (0.54) ERBB2EGFR

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-0912572-B1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LTD (GB) 2003-01-15 — — EP claimed
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