SCHEMBL9008940

SCHEMBL9008940

N#Cc1cc(-c2ccoc2)c2ccc(OCc3cccc(-c4ccc(Cl)cc4)n3)cc2c1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 18/20 0.63
GPR84 Q9NQS5 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL9009080 0.92 ALOX5 (0.66) ALOX5GPR84
SCHEMBL9009119 0.91 ALOX5 (0.63) ALOX5GPR84
SCHEMBL7809023 0.80 ALOX5 (0.64) ALOX5
SCHEMBL9302774 0.77 ALOX5 (0.62) ALOX5
SCHEMBL9009008 0.74 ALOX5 (0.67) ALOX5
SCHEMBL2685256 0.74 ALOX5 (0.66) ALOX5
SCHEMBL2685255 0.73 ALOX5 (1.00) ALOX5
SCHEMBL30108090 0.73 ALOX5 (1.00) ALOX5
SCHEMBL8474402 0.71 ALOX5 (0.57) ALOX5
SCHEMBL9009118 0.71 ALOX5 (0.42) ALOX5KDM4EMEN1MAPTKMT2A

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-5576338-A ANTIALLERGENS, ANTIHISTAMINES, ANTIINFLAMMATORY AGENTS AND CYTOPROTECTIVE AGENTS FOR CARDIOVASCULAR DISORDERS MERCK FROSST CANADA, INC. (CA) 1996-11-19 US disclosed