SCHEMBL26645516

SCHEMBL26645516

CC(C)(C)OC(=O)N1CCn2nc(Nc3ccccc3)cc2C1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.46
▸ JAK2 O60674 5/20 0.43
▸ JAK3 P52333 1/20 0.43
▸ GPR119 Q8TDV5 1/20 0.42
▸ PTPN11 Q06124 1/20 0.42
▸ GRM5 P41594 3/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ NAMPT P43490 1/20 0.41
▸ JAK1 P23458 4/20 0.41
▸ ACHE P22303 1/20 0.41
▸ KIT P10721 1/20 0.40
▸ POLB P06746 1/20 0.40

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
SCHEMBL26645720 0.89 NR1H2 (0.44) NR1H2JAK2JAK3GRM5JAK1
SCHEMBL26645416 0.87 MAPT (0.53) NR1H2JAK2JAK3GPR119JAK1
SCHEMBL26645173 0.86 MAPT (0.52) NR1H2JAK2JAK3GPR119JAK1
SCHEMBL23778205 0.82 ATM (0.46) NR1H2GRM5MAPK1ACHEKIT
SCHEMBL26645437 0.82 GALR2 (0.54) NR1H2JAK2JAK3NAMPTJAK1
SCHEMBL30622856 0.82 GALR2 (0.54) NR1H2JAK2JAK3NAMPTJAK1
SCHEMBL30623068 0.81 GALR2 (0.53) NR1H2JAK2JAK3NAMPTJAK1
SCHEMBL26645091 0.81 GALR2 (0.53) NR1H2JAK2JAK3NAMPTJAK1
SCHEMBL12307580 0.81 MEN1 (0.45) NR1H2ACHE
SCHEMBL12307411 0.80 NR1H2 (0.45) NR1H2GPR119GRM5MAPK1NAMPT

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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