SCHEMBL25606470

SCHEMBL25606470

CN1CCN([C@@H]2CCCN(c3cnc(C(N)=O)c(Nc4ccc(C5CCC6(CC5)CN(C(=O)OC(C)(C)C)C6)cc4)n3)C2)C1=O

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 19/20 0.71
▸ LCK P06239 18/20 0.71
▸ EGFR P00533 9/20 0.71
▸ BTK Q06187 6/20 0.71

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
SCHEMBL21855411 0.93 JAK3 (0.78) JAK3LCKEGFRBTK
SCHEMBL29872120 0.93 JAK3 (0.78) JAK3LCKEGFRBTK
SCHEMBL21946886 0.93 JAK3 (0.75) JAK3LCKEGFRBTK
SCHEMBL21855407 0.92 JAK3 (0.67) JAK3LCKEGFRBTK
SCHEMBL21946321 0.90 JAK3 (0.81) JAK3LCKEGFRBTK
SCHEMBL21855223 0.90 JAK3 (0.68) JAK3LCKEGFRBTK
SCHEMBL25606268 0.90 JAK3 (0.71) JAK3LCKEGFRBTK
SCHEMBL25603497 0.89 JAK3 (0.62) JAK3LCKEGFRBTK
SCHEMBL21946803 0.89 BTK (0.64) JAK3LCKEGFRBTK
SCHEMBL30011960 0.89 BTK (0.64) JAK3LCKEGFRBTK

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-2023088406-A1 FUSED IMIDE DERIVATIVE 正大天晴药业集团股份有限公司 2023-05-25 — — WO disclosed
Send feedback