SCHEMBL24842016

SCHEMBL24842016

COC(=O)c1cnn(CCCCCCO)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
CYP4A11 Q02928 4/20 0.44
CYP4F2 P78329 3/20 0.44
POLB P06746 1/20 0.42
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
GRM2 Q14416 1/20 0.39
TLR8 Q9NR97 1/20 0.38
AGTR1 P30556 1/20 0.36
AGTR2 P50052 1/20 0.36
ACHE P22303 2/20 0.35
HDAC3 O15379 2/20 0.35
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC7 Q8WUI4 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC10 Q969S8 2/20 0.35
HDAC11 Q96DB2 2/20 0.35
HDAC8 Q9BY41 2/20 0.35

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
SCHEMBL7315645 0.88 L3MBTL1 (0.53) L3MBTL1KDM4EALDH1A1HPGDGRM2
SCHEMBL27645962 0.85 L3MBTL1 (0.55) L3MBTL1KDM4EALDH1A1HPGDGRM2
SCHEMBL20541050 0.81 L3MBTL1 (0.44) L3MBTL1CYP4A11CYP4F2KDM4EALDH1A1
SCHEMBL24842014 0.81 L3MBTL1 (0.44) L3MBTL1CYP4A11CYP4F2POLBKDM4E
SCHEMBL2187671 0.81 L3MBTL1 (0.45) L3MBTL1CYP4A11KDM4EALDH1A1HPGD
SCHEMBL24842024 0.81 L3MBTL1 (0.43) L3MBTL1ALDH1A1HPGDACHEHDAC3
SCHEMBL24842015 0.80 L3MBTL1 (0.45) L3MBTL1CYP4A11CYP4F2TLR8ACHE
SCHEMBL22064000 0.80 L3MBTL1 (0.49) L3MBTL1KDM4EALDH1A1HPGDGRM2
SCHEMBL24828550 0.80 L3MBTL1 (0.49) L3MBTL1POLBKDM4EALDH1A1HPGD
SCHEMBL30163007 0.78 NTRK2 (0.43) L3MBTL1POLBKDM4EALDH1A1HPGD

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
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