SCHEMBL28836702

SCHEMBL28836702

COc1cc(N2CCC(C3CNCCO3)CC2)c(-c2cnn(C)c2)cc1Nc1ncc(Br)c(Nc2ccc3nc(C4CC4)ccc3c2P(C)(C)=O)n1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.48
▸ BTK Q06187 1/20 0.48

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
SCHEMBL29208847 0.92 EGFR (0.51) EGFRBTK
SCHEMBL23759824 0.88 EGFR (0.59) EGFRBTK
SCHEMBL23759756 0.87 EGFR (0.58) EGFRBTK
SCHEMBL23759661 0.85 EGFR (0.63) EGFR
SCHEMBL23759752 0.85 EGFR (0.52) EGFRBTK
SCHEMBL22951346 0.85 EGFR (0.55) EGFRBTK
SCHEMBL29857374 0.85 EGFR (0.55) EGFRBTK
SCHEMBL23759814 0.85 EGFR (0.52) EGFRBTK
SCHEMBL23759767 0.84 EGFR (0.59) EGFR
SCHEMBL22950964 0.84 EGFR (0.52) EGFRBTK

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114885607-B Quinolinylphosphine oxide compounds, compositions and uses thereof 贝达药业股份有限公司 2024-05-14 — — CN claimed
CN-114885607-A Quinolylphosphine oxygen compounds, compositions and uses thereof 贝达药业股份有限公司 2022-08-09 — — CN claimed
CN-114885607-B Quinolinylphosphine oxide compounds, compositions and uses thereof 贝达药业股份有限公司 2024-05-14 — — CN disclosed
CN-114885607-A Quinolylphosphine oxygen compounds, compositions and uses thereof 贝达药业股份有限公司 2022-08-09 — — CN disclosed
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