SCHEMBL22804205

SCHEMBL22804205

CCc1cc(Nc2ncc(Br)c(Nc3ccn4ncnc4c3P(C)C)n2)c(OC)cc1N1CCC(N2CCN(C)CC2)CC1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 18/20 0.73
▸ INSR P06213 2/20 0.47
▸ IGF1R P08069 2/20 0.47
▸ ALK Q9UM73 2/20 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
SCHEMBL22804313 0.93 EGFR (0.81) EGFR
SCHEMBL22595571 0.90 EGFR (0.90) EGFRINSRIGF1RALK
SCHEMBL22025902 0.85 EGFR (0.81) EGFR
SCHEMBL22821927 0.85 EGFR (1.00) EGFR
SCHEMBL22821912 0.83 EGFR (1.00) EGFR
SCHEMBL24179126 0.83 EGFR (0.68) EGFRINSRIGF1RALK
SCHEMBL22804171 0.83 EGFR (0.70) EGFR
SCHEMBL23759753 0.83 EGFR (0.66) EGFR
SCHEMBL22596305 0.83 EGFR (0.73) EGFR
SCHEMBL23154348 0.83 EGFR (0.61) EGFRINSRIGF1RALK

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-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