SCHEMBL8557400

SCHEMBL8557400

CON=C(C(=O)Oc1ccc(OCc2ccc3ccc(Cl)cc3n2)cc1)c1ccc(OCc2ccc3ccc(Cl)cc3n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 2/20 0.45
CYSLTR1 Q9Y271 5/20 0.42
CYSLTR2 Q9NS75 3/20 0.42
PDE10A Q9Y233 3/20 0.41
ALOX5 P09917 3/20 0.40
ALOX5AP P20292 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL8552915 0.99 GPBAR1 (0.44) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5
SCHEMBL8554930 0.86 GPBAR1 (0.62) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5
SCHEMBL8555090 0.85 GPBAR1 (0.61) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5
SCHEMBL8557907 0.83 ALOX5 (0.49) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5
SCHEMBL8557020 0.79 GPBAR1 (0.46) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5
SCHEMBL8890687 0.75 GPBAR1 (0.68) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5
SCHEMBL8554714 0.75 PARP10 (0.57) MAOB
SCHEMBL8555940 0.74 ADORA3 (0.41) GPBAR1PDE10AALOX5MRGPRX4MAOB
SCHEMBL9054057 0.74 NPC1 (0.55) GPBAR1CYSLTR1CYSLTR2ALOX5ALOX5AP
SCHEMBL8890262 0.74 GPBAR1 (0.62) GPBAR1CYSLTR1CYSLTR2PDE10AALOX5

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