SCHEMBL24818145

SCHEMBL24818145

COc1cc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)CC2)c(Cl)cc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 14/20 0.79
▸ EGFR P00533 5/20 0.65
▸ INSR P06213 5/20 0.60
▸ IGF1R P08069 5/20 0.60
▸ MAP4K1 Q92918 2/20 0.58
▸ BTK Q06187 1/20 0.56

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
SCHEMBL17410893 0.89 ALK (1.00) ALKEGFRINSRIGF1RMAP4K1
SCHEMBL17411090 0.87 ALK (0.86) ALKEGFRINSRIGF1RMAP4K1
SCHEMBL30761517 0.85 ALK (0.82) ALKEGFRINSRIGF1RBTK
SCHEMBL24940995 0.84 ALK (0.63) ALKEGFRINSRIGF1R
SCHEMBL31498855 0.84 ALK (0.63) ALKEGFRINSRIGF1R
SCHEMBL24818154 0.83 ALK (0.69) ALKEGFRINSRIGF1RBTK
SCHEMBL17410891 0.83 ALK (1.00) ALKEGFRINSRIGF1RMAP4K1
SCHEMBL17411037 0.83 ALK (0.62) ALKEGFRINSRIGF1R
SCHEMBL24816846 0.82 ALK (0.67) ALKEGFRINSRIGF1RBTK
SCHEMBL17410902 0.82 ALK (1.00) ALKEGFRINSRIGF1RMAP4K1

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-2022268229-A1 PROTEIN INHIBITOR OR DEGRADING AGENT, PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PHARMACEUTICAL USE 和径医药科技(上海)有限公司 2022-12-29 — — WO disclosed
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