SCHEMBL6665501

SCHEMBL6665501

O=C1CCCCCCCCCCC(=O)C(=O)CCCCCCCCCCC(=O)C(=O)NCCCCCCCCCC(=O)C(=O)CCCCCCCCCCC1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.50
FKBP5 Q13451 1/20 0.50
OR51E2 Q9H255 1/20 0.40
GAA P10253 3/20 0.39
KDM4E B2RXH2 2/20 0.39
POLB P06746 1/20 0.39
MAP2K1 Q02750 2/20 0.36
ALDH1A1 P00352 5/20 0.35
TRIM24 O15164 2/20 0.35
TRIM33 Q9UPN9 2/20 0.35
RAF1 P04049 1/20 0.33
MAPK1 P28482 1/20 0.33
PRKD1 Q15139 1/20 0.33
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
PDPK1 O15530 1/20 0.30
PARP1 P09874 1/20 0.30
PARP10 Q53GL7 1/20 0.30
PARP11 Q9NR21 1/20 0.30
GFER P55789 1/20 0.30

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
SCHEMBL4662855 0.95
SCHEMBL175988 0.87
SCHEMBL2637407 0.87 FKBP5 (0.43) CRBNFKBP5OR51E2GAAKDM4E
Hydrochloric Acid SCHEMBL29153088 0.84 OR51E2 (0.50) CRBNFKBP5OR51E2GAAKDM4E
Hydrochloric Acid SCHEMBL5806729 0.84
SCHEMBL4618617 0.80 CRBN (0.50) CRBNFKBP5OR51E2GAAKDM4E
SCHEMBL5960403 0.78 CRBN (0.50) CRBNFKBP5OR51E2GAAKDM4E
SCHEMBL11802065 0.78 CRBN (0.50) CRBNFKBP5OR51E2GAAKDM4E
SCHEMBL9110121 0.78 CRBN (0.50) CRBNFKBP5OR51E2GAAKDM4E
SCHEMBL116223 0.75

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
EP-1070722-B1 Silica with polyazacycloalkane units containing more than six nitrogen atoms, process for their preparation and use AIR LIQUIDE (FR) 2004-08-11 EP claimed
EP-1070722-A9 Silica with polyazacycloalkane units containing more than six nitrogen atoms, process for their preparation and use L'AIR LIQUIDE, SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2001-04-04 EP claimed
EP-1070722-A1 Silica with polyazacycloalkane units containing more than six nitrogen atoms, process for their preparation and use L'AIR LIQUIDE, SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2001-01-24 EP claimed