SCHEMBL28529613

SCHEMBL28529613

CCc1cc(Nc2ncnc(Nc3ccc4nccnc4c3P(C)C)n2)c(OC)cc1N1CCC(OC)CC1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.52

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
SCHEMBL28542534 0.91 EGFR (0.56) EGFR
SCHEMBL30626539 0.91 EGFR (0.51) EGFR
SCHEMBL28530485 0.91 EGFR (0.51) EGFR
SCHEMBL28538542 0.91 EGFR (0.59) EGFR
SCHEMBL28531358 0.90 EGFR (0.59) EGFR
SCHEMBL30626523 0.90 EGFR (0.59) EGFR
SCHEMBL28542484 0.89 EGFR (0.66) EGFR
SCHEMBL30626547 0.89 EGFR (0.49) EGFR
SCHEMBL22804404 0.89 EGFR (0.49) EGFR
SCHEMBL28535440 0.89 EGFR (0.56) 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
CN-112513029-A Nitrogen-containing aryl phosphorus oxide derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2021-03-16 — — CN disclosed
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