SCHEMBL30162885

SCHEMBL30162885

OCCOCCn1cccn1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.40
TSHR P16473 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 2/20 0.38
FDPS P14324 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
DAO P14920 1/20 0.35
THRB P10828 2/20 0.35
LMNA P02545 2/20 0.33
HTT P42858 1/20 0.33
PRKAB2 O43741 1/20 0.33
PRKAG1 P54619 1/20 0.33
PRKAA2 P54646 1/20 0.33
PRKAA1 Q13131 1/20 0.33
PRKAG3 Q9UGI9 1/20 0.33
PRKAG2 Q9UGJ0 1/20 0.33
PRKAB1 Q9Y478 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
SCHEMBL3086212 0.90 IDO1 (0.41) IDO1TSHRALDH1A1FDPSL3MBTL1
SCHEMBL31010062 0.82 IDO1 (0.38) IDO1TSHRALDH1A1FDPSL3MBTL1
SCHEMBL30107544 0.81 IDO1 (0.37) IDO1TSHRALDH1A1FDPSDAO
SCHEMBL14722200 0.80 THRB (0.39) IDO1TSHRALDH1A1FDPSL3MBTL1
SCHEMBL31269846 0.79 IDO1 (0.36) IDO1TSHRALDH1A1FDPSDAO
SCHEMBL28515151 0.78 DAO (0.38) IDO1TSHRALDH1A1FDPSL3MBTL1
SCHEMBL2620759 0.75
SCHEMBL29991006 0.75 IDO1 (0.34) IDO1ALDH1A1FDPSDAO
SCHEMBL20282695 0.74
SCHEMBL5713341 0.73 DAO (0.50) IDO1TSHRFDPSDAOTHRB

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