SCHEMBL4454570

SCHEMBL4454570

COC[C@H](C)N(Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)[C@H](C)C(=O)O.COC[C@H](C)N=C(C)C(=O)NCc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.61

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
SCHEMBL4450926 0.90 EGFR (0.74) EGFR
SCHEMBL4448520 0.90 EGFR (0.74) EGFR
SCHEMBL5085599 0.90 EGFR (0.74) EGFR
SCHEMBL5544235 0.84 EGFR (0.65) EGFR
SCHEMBL13600050 0.84 EGFR (0.86) EGFR
SCHEMBL4446929 0.84 EGFR (0.86) EGFR
SCHEMBL5016594 0.83 EGFR (0.63) EGFR
SCHEMBL5022993 0.83 EGFR (0.63) EGFR
SCHEMBL5025540 0.83 EGFR (0.71) EGFR
SCHEMBL5026764 0.83 EGFR (0.71) EGFR

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
US-7632840-B2 Quinazoline compounds for the treatment of hyperproliferative disorders ASTRAZENECA AB (SE) 2009-12-15 US disclosed