SCHEMBL9380491

SCHEMBL9380491

CO[C@]1(c2cc(F)cc(Sc3ccc(C(C)(C)C)cc3)c2)CCO[C@@H](C)C1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.34

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
SCHEMBL9382942 0.85 HSD11B1 (0.34) ALOX5
SCHEMBL9380138 0.85 HSD11B1 (0.34) ALOX5
SCHEMBL9048445 0.85 ALOX5 (0.35) ALOX5
SCHEMBL9049595 0.84 ALOX5 (0.40) ALOX5
SCHEMBL9076931 0.84 ALOX5 (0.40) ALOX5
SCHEMBL9380947 0.83 GRIN2B (0.32) ALOX5
SCHEMBL9046853 0.82 ALOX5 (0.35) ALOX5
SCHEMBL9076464 0.82 ALOX5 (0.35) ALOX5
SCHEMBL9076462 0.82 ALOX5 (0.35) ALOX5
SCHEMBL9383909 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409413-B1 Diaryl ether heterocycles ICI PLC (GB) 1994-08-03 EP claimed
EP-0409413-B1 Diaryl ether heterocycles ICI PLC (GB) 1994-08-03 EP disclosed
US-5208259-A Lipoxygenase enzyme inhibitors IMPERIAL CHEMICAL INDUSTRIES (GB) 1993-05-04 US disclosed
EP-0409413-A2 Diaryl ether heterocycles IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-23 EP disclosed