SCHEMBL30622428

SCHEMBL30622428

C=CC(=O)N1CCn2nc(-c3ccc(F)cc3)c(-c3ccnc4[nH]cc(C)c34)c2C1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 8/20 0.45
▸ CSNK1E P49674 5/20 0.40
▸ CSNK1D P48730 3/20 0.40
▸ EGFR P00533 3/20 0.39
▸ BTK Q06187 2/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ AKT1 P31749 1/20 0.36
▸ AKT1S1 Q96B36 1/20 0.36
▸ FGFR1 P11362 1/20 0.35
▸ FGFR2 P21802 1/20 0.35
▸ FGFR4 P22455 1/20 0.35
▸ FGFR3 P22607 1/20 0.35

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
SCHEMBL26644977 1.00 JAK3 (0.45) JAK3CSNK1ECSNK1DEGFRBTK
SCHEMBL26644982 0.92 JAK3 (0.45) JAK3EGFRBTKAKT1
SCHEMBL30622345 0.92 JAK3 (0.45) JAK3EGFRBTKAKT1
SCHEMBL30622385 0.91 JAK3 (0.43) JAK3CSNK1ECSNK1DEGFRBTK
SCHEMBL26644879 0.91 JAK3 (0.43) JAK3CSNK1ECSNK1DEGFRBTK
SCHEMBL30622424 0.90 JAK3 (0.44) JAK3BTKFGFR2
SCHEMBL26644947 0.90 JAK3 (0.44) JAK3BTKFGFR2
SCHEMBL30622399 0.90 JAK3 (0.43) JAK3CSNK1ECSNK1DBTK
SCHEMBL26644935 0.90 JAK3 (0.43) JAK3CSNK1ECSNK1DBTK
SCHEMBL30622314 0.88 JAK3 (0.41) JAK3CSNK1ECSNK1DBTKFGFR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4519265-A1 IRREVERSIBLE MUTEGFR INHIBITORS Bayer Aktiengesellschaft (DE) 2025-03-12 — — EP claimed
WO-2023213882-A1 IRREVERSIBLE MUTEGFR INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-09 — — WO claimed
EP-4519265-A1 IRREVERSIBLE MUTEGFR INHIBITORS Bayer Aktiengesellschaft (DE) 2025-03-12 — — EP disclosed
WO-2023213882-A1 IRREVERSIBLE MUTEGFR INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-09 — — WO disclosed
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