SCHEMBL9223175

SCHEMBL9223175

COC1(c2cccc(OCc3ccc4ccccc4c3)c2)CCS(=O)(=O)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 18/20 1.00
ADAM17 P78536 1/20 0.50

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
SCHEMBL9356694 0.89 ALOX5 (1.00) ALOX5
SCHEMBL9353041 0.85 ALOX5 (1.00) ALOX5ADAM17
SCHEMBL9388482 0.85 ALOX5 (0.80) ALOX5ADAM17
SCHEMBL9352781 0.85 ALOX5 (0.80) ALOX5ADAM17
SCHEMBL9226727 0.84 ALOX5 (1.00) ALOX5ADAM17
SCHEMBL9388503 0.84 ALOX5 (0.79) ALOX5ADAM17
SCHEMBL9228533 0.84 ALOX5 (1.00) ALOX5
SCHEMBL9356503 0.84 ALOX5 (0.79) ALOX5ADAM17
Ethylene SCHEMBL9356405 0.83 ALOX5 (0.96) ALOX5ADAM17
SCHEMBL9393716 0.82 ALOX5 (0.76) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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