SCHEMBL31155562

SCHEMBL31155562

Cn1cc(-c2cc(Nc3ncc(Br)c(Nc4ccc(F)cc4P(C)(C)=O)n3)c(OC3CC3)cc2N2CCC(N3CCN(C(=O)C(F)(F)F)CC3)CC2)cn1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.55
▸ BTK Q06187 1/20 0.46
▸ INSR P06213 1/20 0.44
▸ IGF1R P08069 1/20 0.44
▸ ALK Q9UM73 1/20 0.44

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
SCHEMBL31155569 1.00 EGFR (0.55) EGFRBTKINSRIGF1RALK
SCHEMBL31155468 0.95 EGFR (0.61) EGFRBTKINSRIGF1RALK
SCHEMBL31155595 0.91 EGFR (0.54) EGFRBTKINSRIGF1RALK
SCHEMBL31155432 0.91 EGFR (0.54) EGFRBTKINSRIGF1RALK
SCHEMBL31155401 0.90 EGFR (0.57) EGFRBTKINSRIGF1RALK
SCHEMBL31155421 0.89 EGFR (0.53) EGFRBTK
SCHEMBL31155487 0.89 EGFR (0.64) EGFR
SCHEMBL31155499 0.88 EGFR (0.56) EGFRBTKINSRIGF1RALK
SCHEMBL31155581 0.87 EGFR (0.52) EGFRBTK
SCHEMBL31155501 0.87 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024217481-A1 EGFR DEGRADING AGENT, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 上海齐鲁制药研究中心有限公司 2024-10-24 — — WO disclosed
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