SCHEMBL9049595

SCHEMBL9049595

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

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 13/20 0.40
LMNA P02545 3/20 0.37
HPGD P15428 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL9076931 1.00 ALOX5 (0.40) ALOX5LMNAHPGDL3MBTL1ALDH1A1
SCHEMBL9076462 0.89 ALOX5 (0.35) ALOX5
SCHEMBL9076464 0.89 ALOX5 (0.35) ALOX5
SCHEMBL9046853 0.89 ALOX5 (0.35) ALOX5
SCHEMBL9049483 0.86 ALOX5 (0.51) ALOX5LMNAHPGDL3MBTL1ALDH1A1
SCHEMBL9048445 0.85 ALOX5 (0.35) ALOX5
SCHEMBL9275422 0.85 LMNA (0.40) ALOX5LMNAHPGDL3MBTL1ALDH1A1
SCHEMBL9275418 0.85 LMNA (0.40) ALOX5LMNAHPGDL3MBTL1ALDH1A1
SCHEMBL9380491 0.84 ALOX5 (0.34) ALOX5
SCHEMBL9049631 0.82 HPGD (0.39) ALOX5LMNAHPGDL3MBTL1ALDH1A1

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-0555068-B1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1996-04-10 EP disclosed
US-5482966-A LIPOXYGENASE ENZYME INHIBITORS AS ANTIINFLAMMATORY AGENTS ZENECA LIMITED (GB) 1996-01-09 US disclosed
US-5332757-A Enzyme inhibitors ZENECA LIMITED (GB) 1994-07-26 US disclosed
EP-0555068-A1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP disclosed