SCHEMBL30622425

SCHEMBL30622425

C=CC(=O)N1CCn2nc(-c3ccc(OC)c(F)c3)c(-c3ccncc3)c2C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 6/20 0.42
EGFR P00533 2/20 0.41
BTK Q06187 8/20 0.40
CSNK1D P48730 4/20 0.40
KDM1A O60341 1/20 0.40
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
CYP17A1 P05093 1/20 0.38
TXK P42681 1/20 0.36
JAK3 P52333 1/20 0.36
FGFR1 P11362 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR3 P22607 1/20 0.36

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
SCHEMBL26644880 1.00 CSNK1E (0.42) CSNK1EEGFRBTKCSNK1DKDM1A
SCHEMBL26644829 0.89 BTK (0.40) CSNK1EEGFRBTKCSNK1DTXK
SCHEMBL30622358 0.89 BTK (0.40) CSNK1EEGFRBTKCSNK1DTXK
SCHEMBL26645610 0.87 BTK (0.39) CSNK1EEGFRBTKCSNK1DKDM1A
SCHEMBL26644936 0.86 CSNK1E (0.41) CSNK1EBTKCSNK1DPDE4APDE4B
SCHEMBL30622850 0.86 CSNK1E (0.42) CSNK1ECSNK1DKDM1APDE4APDE4B
SCHEMBL26645016 0.86 CSNK1E (0.42) CSNK1ECSNK1DKDM1APDE4APDE4B
SCHEMBL30622390 0.85 CSNK1E (0.41) CSNK1EEGFRBTK
SCHEMBL26644886 0.85 CSNK1E (0.41) CSNK1EEGFRBTK
SCHEMBL26644827 0.85 CSNK1D (0.43) CSNK1EBTKCSNK1DFGFR2

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