SCHEMBL9211596

SCHEMBL9211596

OC1COCCC1(O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.46
ADAM17 P78536 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
NR4A2 P43354 1/20 0.41
MAOB P27338 3/20 0.41

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
SCHEMBL9228211 1.00 ALOX5 (0.46) ALOX5ADAM17ALDH1A1CYP4F2CYP4A11
SCHEMBL21253122 0.83 OPRD1 (0.50) ALOX5
SCHEMBL30616184 0.83 OPRD1 (0.50) ALOX5
SCHEMBL9224261 0.82 NPY1R (0.39) ALOX5
SCHEMBL21247931 0.82 OPRD1 (0.49) ALOX5
SCHEMBL9220039 0.80 ALOX5 (0.42) ALOX5ADAM17ALDH1A1
SCHEMBL9217663 0.80 ALOX5 (0.61) ALOX5ALDH1A1
SCHEMBL9137192 0.76 ALOX5 (0.60) ALOX5ALDH1A1CYP4F2CYP4A11
SCHEMBL9136360 0.75 ALOX5 (0.60) ALOX5ALDH1A1MAOB
SCHEMBL7807445 0.75 ALDH1A1 (0.54) ALOX5ADAM17ALDH1A1CYP4F2CYP4A11

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0385662-B1 Heterocycles with inhibitory activity of 5-lipoxygenase ZENECA LTD (GB) 1995-12-13 EP disclosed
US-5403859-A PHENYLENE-CYCLIC ETHER COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-04-04 US disclosed
US-5401751-A Enzyme inhibitors for 5-lipoxygenase ZENECA LIMITED (GB) 1995-03-28 US disclosed
EP-0375404-B1 Heterocyclic derivatives ICI PLC (GB) 1994-02-09 EP disclosed
US-5236919-A Inhibitorsof enzyme 5-lipoxygenase IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-17 US disclosed
US-5234950-A Antiallergens, antiinflammatory agents; cardiovascular disorders, antiarthritic IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-10 US disclosed
US-5134148-A Heterocycles for use as inhibitors of leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-28 US disclosed
US-5098930-A Inhibitors of lipoxygenase for treatment of diseases mediated with leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-03-24 US disclosed
EP-0385662-A2 Heterocycles with inhibitory activity of 5-lipoxygenase ZENECA LIMITED (GB) 1990-09-05 EP disclosed
EP-0375404-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-27 EP disclosed