SCHEMBL9367339

SCHEMBL9367339

COC1(c2cc(F)cc(Sc3ccc4c(ccc(=O)n4C)c3)c2)CCOCC1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.66

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
SCHEMBL9367188 0.87 ALOX5 (0.51) ALOX5
SCHEMBL9367498 0.87 ALOX5 (0.66) ALOX5
SCHEMBL9029548 0.86 ALOX5 (0.63) ALOX5
SCHEMBL9367725 0.82 ALOX5 (0.51) ALOX5
Zd-2138 SCHEMBL1083603 0.79 ALOX5 (1.00) ALOX5
Zd-2138 SCHEMBL29372755 0.79 ALOX5 (1.00) ALOX5
SCHEMBL9367467 0.78 ALOX5 (0.51) ALOX5
SCHEMBL9084328 0.77 ALOX5 (0.52) ALOX5
SCHEMBL9368332 0.77 ALOX5 (0.50) ALOX5
SCHEMBL9099705 0.77 ALOX5 (0.71) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420511-B1 Heterocyclic derivatives ICI PLC (GB) 1994-08-17 EP claimed
EP-0420511-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-03 EP claimed
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-5221677-A For treating diseases mediated by leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-22 US disclosed
EP-0420511-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-03 EP disclosed