SCHEMBL6939829

SCHEMBL6939829

O=C1OC(=C(Br)Br)C=C1CCCCO

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.32
DAO P14920 1/20 0.31

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
SCHEMBL15687540 0.98 ALOX5 (0.34) ALOX5DAO
SCHEMBL15687558 0.98 ALOX5 (0.34) ALOX5DAO
SCHEMBL4414859 0.86
SCHEMBL1421273 0.85 STAT3 (0.30)
SCHEMBL6943401 0.85
SCHEMBL15687364 0.85 STAT3 (0.30)
SCHEMBL15687665 0.83 ACHE (0.44) ALOX5
SCHEMBL6138334 0.83 ACHE (0.44) ALOX5
SCHEMBL1548523 0.83 ACHE (0.35) ALOX5
SCHEMBL4416086 0.83

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
WO-2014071457-A1 DUAL ACTION NITRIC OXIDE DONORS AND THEIR USE AS ANTIMICROBIAL AGENTS NEWSOUTH INNOVATIONS PTY LIMITED (AU) 2014-05-15 WO disclosed
EP-1071677-A4 PRODUCTION OF FURANONES UNISEARCH LTD (AU) 2003-04-02 EP disclosed
EP-1071677-A1 PRODUCTION OF FURANONES UNISEARCH LIMITED (AU) 2001-01-31 EP disclosed
WO-1999054323-A1 PRODUCTION OF FURANONES UNISEARCH LIMITED (AU) 1999-10-28 WO disclosed