SCHEMBL22804167

SCHEMBL22804167

CCc1cc(Nc2ncc(Br)c(Nc3ccc4nccnc4c3P(C)C)n2)c(OC)cc1N1CCC(N2CC(N(C)C)C2)CC1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.81

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
SCHEMBL28530948 0.93 EGFR (0.70) EGFR
SCHEMBL28908537 0.92 EGFR (0.81) EGFR
SCHEMBL22804401 0.92 EGFR (0.69) EGFR
SCHEMBL22804201 0.92 EGFR (0.75) EGFR
SCHEMBL28541785 0.92 EGFR (0.79) EGFR
SCHEMBL28531371 0.91 EGFR (0.69) EGFR
SCHEMBL28527675 0.91 EGFR (0.81) EGFR
SCHEMBL28524743 0.91 EGFR (0.71) EGFR
SCHEMBL30626526 0.91 EGFR (0.67) EGFR
SCHEMBL28527684 0.91 EGFR (0.70) 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 3 patents. 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
WO-2020253862-A1 NITROGEN-CONTAINING ARYL PHOSPHORUS OXIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2020-12-24 — — WO disclosed
WO-2020253862-A1 NITROGEN-CONTAINING ARYL PHOSPHORUS OXIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2020-12-24 — — WO disclosed
Send feedback