SCHEMBL24841213

SCHEMBL24841213

NC(=O)c1cn(CCOCCO)cn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ADA P00813 6/20 0.39
▸ KDM2B Q8NHM5 1/20 0.37
▸ JAK3 P52333 1/20 0.35
▸ TBXAS1 P24557 5/20 0.35
▸ GRM2 Q14416 1/20 0.33
▸ CPB2 Q96IY4 3/20 0.33
▸ CPB1 P15086 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMYD3 Q9H7B4 1/20 0.32

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
SCHEMBL30162824 0.82 MEN1 (0.39) KDM2BJAK3GRM2CPB2CPB1
SCHEMBL24842792 0.81 SMYD3 (0.37) KDM2BCPB2SMYD3
SCHEMBL24842010 0.78 ADA (0.40) ADAJAK3GRM2CPB2CPB1
SCHEMBL24842794 0.78 ADA (0.40) ADAJAK3GRM2CPB2CPB1
SCHEMBL28309917 0.77 ADA (0.46) ADAGRM2SMYD3
SCHEMBL24841247 0.76 ADA (0.39) ADAGRM2CPB2CPB1SMYD3
SCHEMBL6335386 0.76 KDM5A (0.46) ADACPB2CPB1SMYD3
SCHEMBL27781554 0.73 CPB2 (0.47) ADACPB2CPB1SMYD3
SCHEMBL12286925 0.73 SCD (0.46) JAK3GRM2SMYD3
Hydrochloric Acid SCHEMBL28773709 0.72 ADA (0.38) ADAGRM2CPB2CPB1SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023277517-A1 ACYCLIC NUCLEIC ACID MIMIC COMPRISING PENTACYCLIC BASE 동아대학교 산학협력단 2023-01-05 — — WO claimed
WO-2023277517-A1 ACYCLIC NUCLEIC ACID MIMIC COMPRISING PENTACYCLIC BASE 동아대학교 산학협력단 2023-01-05 — — WO disclosed
WO-2023277517-A1 ACYCLIC NUCLEIC ACID MIMIC COMPRISING PENTACYCLIC BASE 동아대학교 산학협력단 2023-01-05 — — WO disclosed
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