SCHEMBL26167740

SCHEMBL26167740

CSSC(C)(COc1cccc(C(=O)NCCOCCOCCOCCCC(C)C)c1)OCCOCC(=O)NCC#CC(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MAOB P27338 2/20 0.33
▸ NR1H4 Q96RI1 1/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ SMPD1 P17405 3/20 0.33
▸ DRD2 P14416 2/20 0.32
▸ DRD4 P21917 2/20 0.32
▸ DRD3 P35462 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL26167728 0.94 GAA (0.36) GAAMAPTMAOBNR1H4ALDH1A1
SCHEMBL26167743 0.94 SMN1; SMN2 (0.35) GAAMAPTMAOBNR1H4ALDH1A1
SCHEMBL22598280 0.93 GAA (0.38) GAAMAPTMAOBALDH1A1SMPD1
SCHEMBL22598381 0.93 GAA (0.38) GAAMAPTMAOBALDH1A1SMPD1
SCHEMBL22327329 0.93 GAA (0.38) GAAMAPTMAOBALDH1A1SMPD1
SCHEMBL26068370 0.92 GAA (0.37) GAAMAPTMAOBALDH1A1SMPD1
SCHEMBL26167741 0.92 GAA (0.36) GAAMAPTMAOBNR1H4ALDH1A1
SCHEMBL22327213 0.89 ALDH1A1 (0.35) GAAMAPTMAOBALDH1A1SMPD1
SCHEMBL22327242 0.89 ALDH1A1 (0.35) GAAMAPTMAOBALDH1A1SMPD1
SCHEMBL22598408 0.89 ALDH1A1 (0.35) GAAMAPTMAOBALDH1A1SMPD1

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
US-20230160001-A1 NUCLEOTIDE CLEAVABLE LINKERS WITH RIGID SPACERS AND USES THEREOF FIRST-CITIZENS BANK & TRUST COMPANY 2023-05-25 — — US disclosed
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