SCHEMBL9028206

SCHEMBL9028206

COC1(c2cccc(Sc3ccc4c(c3)n(C)c(=O)n4C)c2)CCOCC1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 19/20 0.51
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL9029548 0.86 ALOX5 (0.63) ALOX5
SCHEMBL9367498 0.85 ALOX5 (0.66) ALOX5
SCHEMBL9026717 0.84 ALOX5 (0.54) ALOX5
SCHEMBL9026909 0.84 ALOX5 (0.53) ALOX5
SCHEMBL9371367 0.82 ALOX5 (0.56) ALOX5
SCHEMBL9027549 0.80 ALOX5 (0.52) ALOX5MEN1KMT2A
SCHEMBL9098781 0.79 ALOX5 (0.56) ALOX5
SCHEMBL9440429 0.78 ALOX5 (0.44) ALOX5
SCHEMBL9384495 0.78 ALOX5 (0.44) ALOX5
SCHEMBL9380811 0.78 ALOX5 (0.61) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0462831-B1 Bicyclic pyran derivatives and their use as inhibitors of 5-lipoxygenase ZENECA LTD (GB) 1996-02-28 EP claimed
US-5179115-A Antiinflammatory agents, antiallergens IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-01-12 US claimed
JP-4243865-A None JP disclosed
EP-0462831-B1 Bicyclic pyran derivatives and their use as inhibitors of 5-lipoxygenase ZENECA LTD (GB) 1996-02-28 EP disclosed
US-5462953-A Benzoxazolyl derivatives useful as 5-lipoxygenase inhibitors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-10-31 US disclosed
US-5364877-A Antiinflammatory agents, antiallergens ICI PHARMA (GB) 1994-11-15 US disclosed
US-5278177-A Enzyme inhibitory IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-11 US disclosed
US-5179115-A Antiinflammatory agents, antiallergens IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-01-12 US disclosed
JP-H04243865-A BICYCLIC HETEROCYCLIC DERIVATIVE, ITS PRODUCTION AND PHARMACEUTICAL COMPOSITE FOR TREATMENT OF LEUKOTRIENE INTERMEDIATED DISEASE OR MEDICAL ABNORMALITY ICI PHARMA 1992-08-31 JP disclosed
EP-0462831-A2 Bicyclic pyran derivatives and their use as inhibitors of 5-lipoxygenase ZENECA LIMITED (GB) 1991-12-27 EP disclosed