SCHEMBL9367706

SCHEMBL9367706

COC1(c2cc(F)cc(Cc3ccccc3)c2)CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 17/20 0.50
PTGS1 P23219 5/20 0.48
PTGS2 P35354 5/20 0.48

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
SCHEMBL9128750 0.84 DPP4 (0.43) ALOX5PTGS1PTGS2
SCHEMBL9029002 0.81 ALOX5 (0.70) ALOX5PTGS1PTGS2
SCHEMBL9367698 0.81 ALOX5 (0.47) ALOX5PTGS1PTGS2
SCHEMBL7481034 0.80 ALOX5 (0.53) ALOX5PTGS1PTGS2
SCHEMBL9367762 0.80 ALOX5 (0.41) ALOX5
SCHEMBL6748248 0.78 ALOX5 (0.48) ALOX5PTGS1PTGS2
SCHEMBL9440584 0.77 ALOX5 (0.48) ALOX5PTGS1PTGS2
SCHEMBL9440157 0.77 ALOX5 (0.53) ALOX5PTGS1PTGS2
SCHEMBL6026012 0.76 ALOX5 (0.47) ALOX5PTGS1PTGS2
SCHEMBL8550340 0.75 ALOX5 (0.61) ALOX5PTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420511-B1 Heterocyclic derivatives ICI PLC (GB) 1994-08-17 EP disclosed
US-5302594-A Antiinflammatory agents; antiallergenic agents IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-04-12 US disclosed
US-5258399-A 5-lipoxygenase inhibitors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-11-02 US disclosed
US-5236948-A Lipoxygenase inhibitor IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-17 US disclosed
US-5221677-A For treating diseases mediated by leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-22 US disclosed
EP-0495594-A1 Sulphonamide derivatives ZENECA LIMITED (GB) 1992-07-22 EP disclosed
EP-0420511-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-03 EP disclosed