SCHEMBL9224997

SCHEMBL9224997

COC1(c2cccc(OCc3ccc4ccccc4c3)c2)CCOC1C

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 19/20 0.64
ADAM17 P78536 1/20 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
SCHEMBL9224919 0.82 ALOX5 (0.66) ALOX5ADAM17
SCHEMBL9223138 0.82 ALOX5 (0.66) ALOX5ADAM17
SCHEMBL9352666 0.79 ALOX5 (0.63) ALOX5ADAM17
SCHEMBL9352661 0.79 ALOX5 (0.63) ALOX5ADAM17
SCHEMBL9389854 0.79 ALOX5 (0.63) ALOX5ADAM17
SCHEMBL9352673 0.79 ALOX5 (0.63) ALOX5ADAM17
SCHEMBL10382905 0.78 ALOX5 (0.72) ALOX5ADAM17
SCHEMBL9221345 0.78 ALOX5 (0.57) ALOX5ADAM17
SCHEMBL9227980 0.78 ALOX5 (0.57) ALOX5ADAM17
SCHEMBL9228816 0.78 ALOX5 (0.57) ALOX5ADAM17

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-0375404-B1 Heterocyclic derivatives ICI PLC (GB) 1994-02-09 EP claimed
US-5234950-A Antiallergens, antiinflammatory agents; cardiovascular disorders, antiarthritic IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-10 US claimed
EP-0375404-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-27 EP claimed
US-5403859-A PHENYLENE-CYCLIC ETHER COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-04-04 US disclosed
EP-0375404-B1 Heterocyclic derivatives ICI PLC (GB) 1994-02-09 EP disclosed
US-5234950-A Antiallergens, antiinflammatory agents; cardiovascular disorders, antiarthritic IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-10 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-0375404-A2 Heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-27 EP disclosed