SCHEMBL26645306

SCHEMBL26645306

CC(C)(C)OC(=O)N1CCn2nc(-c3ccc(F)cc3)c(-c3ccnc(NC(=O)C4CC4)c3)c2C1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 19/20 0.49
▸ GSK3B P49841 13/20 0.49
▸ MAPK8 P45983 5/20 0.47
▸ MAPK10 P53779 5/20 0.47
▸ GSK3A P49840 3/20 0.46
▸ CSNK1D P48730 1/20 0.43
▸ CSNK1E P49674 1/20 0.43

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
SCHEMBL30622861 0.95 MAPK14 (0.45) MAPK14GSK3BMAPK8MAPK10GSK3A
SCHEMBL26645020 0.92 CSNK1E (0.45) MAPK14GSK3BCSNK1DCSNK1E
SCHEMBL30622893 0.87 CSNK1E (0.41) MAPK14GSK3BCSNK1DCSNK1E
SCHEMBL26645300 0.86 CSNK1E (0.43) MAPK14MAPK8MAPK10CSNK1DCSNK1E
SCHEMBL26644894 0.86 MAPK14 (0.49) MAPK14GSK3BMAPK8MAPK10GSK3A
SCHEMBL26645795 0.85 CSNK1E (0.47) CSNK1DCSNK1E
SCHEMBL24554208 0.85 MAPK14 (0.56) MAPK14GSK3BMAPK8MAPK10GSK3A
SCHEMBL29682939 0.85 MAPK14 (0.56) MAPK14GSK3BMAPK8MAPK10GSK3A
SCHEMBL24554177 0.85 CSNK1E (0.45) MAPK14MAPK8MAPK10CSNK1DCSNK1E
SCHEMBL30579563 0.85 CSNK1E (0.45) MAPK14MAPK8MAPK10CSNK1DCSNK1E

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
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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