SCHEMBL25606236

SCHEMBL25606236

CCOC(=O)[C@@H](/C=C/C(C)(C)C)NC(=O)C1CN(c2ccncc2)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NR1H3 Q13133 8/20 0.40
▸ NR1H2 P55055 8/20 0.40
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ EIF2AK4 Q9P2K8 1/20 0.35
▸ TGM2 P21980 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ SUV39H2 Q9H5I1 2/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ USP30 Q70CQ3 1/20 0.34
▸ ITGB3 P05106 1/20 0.34
▸ ITGA2B P08514 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ GPR119 Q8TDV5 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
SCHEMBL25221694 1.00 NR1H3 (0.40) NR1H3NR1H2MEN1KMT2AEIF2AK4
SCHEMBL25606317 0.91 NR1H2 (0.41) NR1H3NR1H2EIF2AK4MAP4K4USP30
SCHEMBL29252894 0.91 NR1H2 (0.41) NR1H3NR1H2EIF2AK4MAP4K4USP30
SCHEMBL25251258 0.91 NR1H2 (0.41) NR1H3NR1H2EIF2AK4MAP4K4USP30
SCHEMBL25220207 0.86 GPR119 (0.43) NR1H3NR1H2MEN1KMT2AEIF2AK4
SCHEMBL38663567 0.78 NR1H2 (0.48) NR1H3NR1H2MEN1KMT2AEIF2AK4
SCHEMBL25263043 0.76 GPR119 (0.45) NR1H3NR1H2EIF2AK4TGM2MAP4K4
SCHEMBL29252847 0.76 GPR119 (0.45) NR1H3NR1H2EIF2AK4TGM2MAP4K4
SCHEMBL25606205 0.75 NR1H2 (0.63) NR1H3NR1H2MAPTMAP4K4USP30
SCHEMBL25216734 0.75 NR1H2 (0.49) NR1H3NR1H2MAPTMAP4K4USP30

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-2023101595-A1 SORTILIN INHIBITORS SORTINA PHARMA AB (SE) 2023-06-08 — — WO disclosed
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