SCHEMBL26645893

SCHEMBL26645893

CC(C)(C)OC(=O)N1CCn2nc(Nc3ccc(C(F)(F)F)cc3)c(Br)c2C1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.51
▸ JAK2 O60674 6/20 0.44
▸ JAK1 P23458 4/20 0.44
▸ BRD4 O60885 1/20 0.43
▸ CREBBP Q92793 1/20 0.43
▸ MKNK1 Q9BUB5 2/20 0.43
▸ GPR119 Q8TDV5 4/20 0.43
▸ TRPV1 Q8NER1 2/20 0.40
▸ NR3C1 P04150 1/20 0.39
▸ JAK3 P52333 3/20 0.39
▸ PTK2 Q05397 3/20 0.39
▸ TGFBR1 P36897 1/20 0.39

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
SCHEMBL26645738 0.99 MAPT (0.50) MAPTJAK2JAK1BRD4CREBBP
SCHEMBL26645058 0.90 JAK2 (0.45) JAK2JAK1BRD4CREBBPMKNK1
SCHEMBL26645037 0.88 JAK2 (0.44) JAK2JAK1MKNK1GPR119JAK3
SCHEMBL26645254 0.86 MAPT (0.48) MAPTJAK2JAK1BRD4CREBBP
SCHEMBL26645138 0.82 GALR2 (0.48) MAPTJAK2JAK1MKNK1JAK3
SCHEMBL26645717 0.78 MKNK1 (0.55) MKNK1GPR119
SCHEMBL26645416 0.78 MAPT (0.53) MAPTJAK2JAK1GPR119TRPV1
SCHEMBL26645173 0.77 MAPT (0.52) MAPTJAK2JAK1GPR119TRPV1
SCHEMBL30623059 0.77 JAK1 (0.43) MAPTJAK2JAK1BRD4CREBBP
SCHEMBL26645199 0.77 JAK2 (0.43) JAK2JAK1BRD4CREBBPJAK3

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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