SCHEMBL22918771

SCHEMBL22918771

CC(C)(C)OCNCc1ccc(-c2cnn(C3COC3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 2/20 0.38
▸ EIF4E P06730 1/20 0.38
▸ MKNK2 Q9HBH9 1/20 0.38
▸ LRRK2 Q5S007 2/20 0.37
▸ KIT P10721 2/20 0.37
▸ BRD4 O60885 2/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ ABL1 P00519 1/20 0.36
▸ PIM1 P11309 2/20 0.35
▸ TTK P33981 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ ALOX5AP P20292 3/20 0.34
▸ NTRK1 P04629 1/20 0.34
▸ MET P08581 2/20 0.34
▸ PIM2 Q9P1W9 1/20 0.33

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
SCHEMBL28862445 0.80 EIF4E (0.42) MKNK1EIF4EMKNK2KITBRD4
SCHEMBL28862512 0.74 KIT (0.48) MKNK1EIF4EMKNK2LRRK2KIT
SCHEMBL29614332 0.70 MKNK1 (0.47) MKNK1EIF4EMKNK2LRRK2KIT
SCHEMBL17113554 0.65 LPL (0.47) MKNK1EIF4EMKNK2LRRK2KIT
SCHEMBL19576506 0.64 ROCK1 (0.46) MKNK1EIF4EMKNK2BRD4CREBBP
SCHEMBL24958712 0.64 BRD4 (0.45) MKNK1EIF4EMKNK2KITBRD4
SCHEMBL25589668 0.64 MKNK1 (0.53) MKNK1EIF4EMKNK2LRRK2KIT
SCHEMBL25813223 0.63 CXCR3 (0.39) —
SCHEMBL12690557 0.62 PIM1 (0.39) MKNK1EIF4EMKNK2LRRK2KIT
SCHEMBL15382060 0.62 PIM1 (0.39) MKNK1EIF4EMKNK2LRRK2KIT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021013864-A1 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL) -PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2021-01-28 — — WO disclosed
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