SCHEMBL8480268

SCHEMBL8480268

CCOC(=O)C(c1ccc2ccc(OCc3ccc4ccccc4n3)cc2c1)C1CCCCCC1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 18/20 0.66
HDAC6 Q9UBN7 1/20 0.65
ALOX5AP P20292 1/20 0.56
PDE4A P27815 1/20 0.54
PDE4B Q07343 1/20 0.54
PDE4C Q08493 1/20 0.54
PDE4D Q08499 1/20 0.54
PDE3B Q13370 1/20 0.54
PDE3A Q14432 1/20 0.54

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
SCHEMBL27629358 0.91 ALOX5 (0.78) ALOX5HDAC6
SCHEMBL8827882 0.83 ALOX5 (0.80) ALOX5HDAC6ALOX5AP
SCHEMBL9430158 0.83 ALOX5 (0.80) ALOX5HDAC6ALOX5AP
SCHEMBL8827857 0.83 ALOX5 (0.80) ALOX5HDAC6ALOX5AP
SCHEMBL9431826 0.83 ALOX5 (0.80) ALOX5HDAC6ALOX5AP
SCHEMBL9124326 0.83 ALOX5 (0.80) ALOX5HDAC6ALOX5AP
SCHEMBL8799518 0.82 ALOX5 (0.79) ALOX5HDAC6ALOX5AP
SCHEMBL26838881 0.81 ALOX5 (0.84) ALOX5HDAC6
SCHEMBL9154289 0.81 ALOX5 (0.75) ALOX5HDAC6
SCHEMBL9151239 0.81 ALOX5 (0.75) ALOX5HDAC6

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
US-5925646-A Heterocyclic aryl-, alkyl- and cycloalkylacetamides BAYER AKTIENGESELLSCHAFT (DE) 1999-07-20 US disclosed
US-5747505-A Heterocyclic aryl-, alkyl- and cycloalkylacetamides BAYER AKTIENGESELLSCHAFT (DE) 1998-05-05 US disclosed