SCHEMBL11022385

SCHEMBL11022385

CCCc1c(OC)c(Cl)c2oc(Cc3ccc(OCC(=O)OCC)cc3)c(C)c2c1C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 15/20 0.48
ALOX15 P16050 1/20 0.44
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL9739138 0.76 ALOX5 (0.68) ALOX5ALOX15MAPTLMNAPOLB
SCHEMBL9739854 0.73 ALOX5 (0.64) ALOX5ALOX15MAPTLMNAPOLB
SCHEMBL11460802 0.66 NPSR1 (0.57) MAPTLMNAPOLB
SCHEMBL9742519 0.66 ALOX5 (0.69) ALOX5ALOX15
SCHEMBL9739591 0.65 ALOX5 (1.00) ALOX5ALOX15
SCHEMBL5202817 0.64 GAA (0.66) MAPTPOLB
SCHEMBL9739535 0.63 ALOX5 (0.59) ALOX5ALOX15
SCHEMBL9739661 0.63 ALOX5 (0.72) ALOX5ALOX15
SCHEMBL6941063 0.63 GAA (0.64) MAPTLMNAPOLB
SCHEMBL435444 0.63 GAA (0.68) MAPTLMNAPOLB

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
EP-0165810-A2 Benzofuran and benzothiophene derivatives, their use in inhibiting mammalian leukotriene biosynthesis, and pharmaceutical compositions containing these derivatives MERCK FROSST CANADA INC. (CA) 1985-12-27 EP disclosed