SCHEMBL30622893

SCHEMBL30622893

CC(C)(C)OC(=O)N1CCn2nc(-c3ccc(F)cc3)c(Br)c2C1.CC(C)(C)OC(=O)Nc1cc(-c2c(-c3ccc(F)cc3)nn3c2CN(C(=O)OC(C)(C)C)CC3)ccn1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 7/20 0.41
▸ CSNK1D P48730 7/20 0.41
▸ RIPK3 Q9Y572 1/20 0.41
▸ SLC34A1 Q06495 4/20 0.38
▸ GRIA1 P42261 1/20 0.37
▸ MAPK14 Q16539 4/20 0.37
▸ NR3C2 P08235 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ TGFBR1 P36897 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
SCHEMBL26645020 0.95 CSNK1E (0.45) CSNK1ECSNK1DRIPK3SLC34A1GRIA1
SCHEMBL30622861 0.92 MAPK14 (0.45) CSNK1ECSNK1DSLC34A1MAPK14GSK3B
SCHEMBL26645749 0.89 CSNK1E (0.45) CSNK1ECSNK1DRIPK3MAPK14NR3C2
SCHEMBL24554177 0.89 CSNK1E (0.45) CSNK1ECSNK1DRIPK3GRIA1MAPK14
SCHEMBL30579563 0.89 CSNK1E (0.45) CSNK1ECSNK1DRIPK3GRIA1MAPK14
2-Aminopyridine SCHEMBL30623047 0.88 CSNK1E (0.41) CSNK1ECSNK1DRIPK3SLC34A1MAPK14
SCHEMBL26645306 0.87 MAPK14 (0.49) CSNK1ECSNK1DMAPK14GSK3B
SCHEMBL30623021 0.86 CSNK1E (0.44) CSNK1ECSNK1DGRIA1MAPK14
SCHEMBL28875910 0.85 RIPK3 (0.45) CSNK1ECSNK1DRIPK3MAPK14NR3C2
SCHEMBL26645795 0.84 CSNK1E (0.47) CSNK1ECSNK1DSLC34A1GRIA1

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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