SCHEMBL6138334

SCHEMBL6138334

CCCCCCC1=CC(=C(Br)Br)OC1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
BACE1 P56817 1/20 0.44
PTPN1 P18031 1/20 0.42
CDC25A P30304 6/20 0.40
CDC25B P30305 6/20 0.40
CDC25C P30307 5/20 0.40
ALOX5 P09917 12/20 0.39
PTGS2 P35354 4/20 0.39
GLS2 Q9UI32 1/20 0.39
MPEG1 Q2M385 6/20 0.36
XIAP P98170 2/20 0.36
GPR84 Q9NQS5 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
PTGES O14684 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL15687665 1.00 ACHE (0.44) ACHEBACE1PTPN1CDC25ACDC25B
SCHEMBL1548523 0.93 ACHE (0.35) ACHEBACE1PTPN1CDC25ACDC25B
SCHEMBL15692273 0.89 CDC25A (0.36) ACHEBACE1PTPN1CDC25ACDC25B
SCHEMBL6135976 0.85 ACHE (0.30) ACHEBACE1PTPN1
SCHEMBL6939829 0.83 ALOX5 (0.32) ALOX5
SCHEMBL6943401 0.82
SCHEMBL4416086 0.80
SCHEMBL14613199 0.79
SCHEMBL8921071 0.78 ACHE (0.50) ACHEBACE1PTPN1CDC25ACDC25B
SCHEMBL6413040 0.78 ACHE (0.50) ACHEBACE1PTPN1CDC25ACDC25B

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
EP-1787988-A2 Production of furanones Biosignal Australia Pty Limited (AU) 2007-05-23 EP disclosed
US-20050215772-A1 Furanone derivatives and methods of making same BIOSIGNAL LIMITED (AT) 2005-09-29 US disclosed
EP-1539692-A4 FURANONE DERIVATIVES AND METHODS OF MAKING SAME BIOSIGNAL LTD (AU) 2005-08-24 EP disclosed
EP-1539692-A1 FURANONE DERIVATIVES AND METHODS OF MAKING SAME Biosignal Limited (AU) 2005-06-15 EP disclosed
WO-2004016588-A1 FURANONE DERIVATIVES AND METHODS OF MAKING SAME BIOSIGNAL LIMITED (AU) 2004-02-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050215772-A1 Furanone derivatives and methods of making same PFAS, CFAP20, FDPS ACHE 1264/4885BACE1 2163/4885PTPN1 4196/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.