SCHEMBL28530455

SCHEMBL28530455

COc1cc(N2CCC(N3CC(N(C)C)C3)CC2)c(C)cc1Nc1ncc(Cl)c(Nc2ccc3nccnc3c2P(C)C)n1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.79
▸ INSR P06213 1/20 0.53
▸ IGF1R P08069 1/20 0.53
▸ ALK Q9UM73 1/20 0.53

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
SCHEMBL28536447 0.93 EGFR (0.69) EGFR
SCHEMBL28541785 0.92 EGFR (0.79) EGFR
SCHEMBL28541783 0.92 EGFR (0.67) EGFR
SCHEMBL28908537 0.92 EGFR (0.81) EGFR
SCHEMBL22804181 0.91 EGFR (0.68) EGFR
SCHEMBL28910224 0.91 EGFR (0.80) EGFR
SCHEMBL28529314 0.91 EGFR (0.67) EGFRINSRIGF1RALK
SCHEMBL28524733 0.90 EGFR (0.65) EGFR
SCHEMBL28542463 0.90 EGFR (0.68) EGFRINSRIGF1RALK
SCHEMBL28536036 0.90 EGFR (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112513029-B 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 2023-10-24 — — CN disclosed
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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