SCHEMBL8557925

SCHEMBL8557925

O=C(O)C(=NO)C(c1ccc(OCc2ccc3cc(F)ccc3n2)cc1)c1ccc(OCc2ccc3cc(F)ccc3n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.56
CYSLTR2 Q9NS75 4/20 0.45
CYSLTR1 Q9Y271 4/20 0.45
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE10A Q9Y233 2/20 0.43
GPBAR1 Q8TDU6 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
HDAC6 Q9UBN7 1/20 0.42
ALOX5AP P20292 1/20 0.42

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
SCHEMBL8557903 1.00 ALOX5 (0.56) ALOX5CYSLTR2CYSLTR1PDE4APDE4B
SCHEMBL7604022 0.87 ALOX5 (0.57) ALOX5CYSLTR2CYSLTR1PDE4APDE4B
SCHEMBL8554925 0.85 GPBAR1 (0.61) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6
SCHEMBL8555246 0.85 GPBAR1 (0.61) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6
SCHEMBL8555104 0.84 GPBAR1 (0.60) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6
SCHEMBL8555687 0.84 GPBAR1 (0.60) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6
SCHEMBL8557396 0.82 ALOX5 (0.44) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6
SCHEMBL8557412 0.82 ALOX5 (0.44) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6
SCHEMBL8552913 0.81 ALOX5 (0.44) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6
SCHEMBL8552934 0.81 ALOX5 (0.44) ALOX5CYSLTR2CYSLTR1GPBAR1HDAC6

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-5714488-A FOR TREATMENT OF ALLERGIC AND INFLAMMATORY DISEASE STATES ABBOTT LABORATORIES (US) 1998-02-03 US claimed
US-5714488-A FOR TREATMENT OF ALLERGIC AND INFLAMMATORY DISEASE STATES ABBOTT LABORATORIES (US) 1998-02-03 US disclosed