SCHEMBL9367498

SCHEMBL9367498

COC1(c2cccc(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
SCHEMBL9098781 0.87 ALOX5 (0.56) ALOX5
SCHEMBL9367339 0.87 ALOX5 (0.66) ALOX5
SCHEMBL9853211 0.86 ALOX5 (0.51) ALOX5
SCHEMBL9367111 0.86 ALOX5 (0.51) ALOX5
SCHEMBL9853206 0.86 ALOX5 (0.51) ALOX5
SCHEMBL9028206 0.85 ALOX5 (0.51) ALOX5
SCHEMBL9367482 0.85 ALOX5 (0.52) ALOX5
SCHEMBL9371367 0.84 ALOX5 (0.56) ALOX5
SCHEMBL9367467 0.84 ALOX5 (0.51) ALOX5
SCHEMBL9367746 0.84 ALOX5 (0.52) 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 8 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
JP-3130281-A None JP disclosed
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
JP-H03130281-A HETEROCYCLIC DERIVATIVE, PREPARATION OF THE SAME, AND PHARMACOLOGICAL COMPOSITION FOR DISEASE CAUSED BY LEUKOTRIENE, AND MEDICAL TREATMENT OF THE SAME ICI PHARMA 1991-06-04 JP disclosed
EP-0420511-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-03 EP disclosed