SCHEMBL9049933

SCHEMBL9049933

CC1OCCC1(O)c1nccs1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.37
OPRL1 P41146 1/20 0.35
ALOX15 P16050 1/20 0.32
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL9048558 0.76 BACE1 (0.36) BACE1
SCHEMBL17151565 0.69 OPRL1 (0.47) BACE1OPRL1ALOX15HPGD
SCHEMBL9049881 0.68 OPRL1 (0.49) BACE1OPRL1
SCHEMBL9048334 0.66
SCHEMBL14860791 0.66 OPRL1 (0.35) OPRL1
SCHEMBL1356638 0.65 OPRL1 (0.53) OPRL1
SCHEMBL2018541 0.65 OPRL1 (0.33) OPRL1
SCHEMBL8553060 0.65
SCHEMBL29946411 0.65 OPRL1 (0.35) OPRL1
SCHEMBL743084 0.65 OPRL1 (0.46) OPRL1ALOX15

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