SCHEMBL25002043

SCHEMBL25002043

COc1cc(N2CCC(OC)C2)c(-c2cnn(C)c2)cc1Nc1ncc(Br)c(Nc2ccc3nccnc3c2P(C)C)n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.51
▸ TTK P33981 1/20 0.47

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
SCHEMBL25001947 0.93 EGFR (0.54) EGFR
SCHEMBL25001702 0.92 EGFR (0.51) EGFR
SCHEMBL25002651 0.92 EGFR (0.58) EGFR
SCHEMBL25001837 0.92 EGFR (0.53) EGFRTTK
SCHEMBL25001567 0.91 EGFR (0.48) EGFR
SCHEMBL25002887 0.91 EGFR (0.52) EGFR
SCHEMBL25001581 0.91 EGFR (0.51) EGFR
SCHEMBL25001704 0.90 EGFR (0.63) EGFR
SCHEMBL25002038 0.90 EGFR (0.64) EGFR
SCHEMBL25002508 0.90 EGFR (0.52) 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
EP-4129996-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-02-08 — — EP disclosed
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