SCHEMBL1707516

SCHEMBL1707516

COC(=O)c1coc(CCCCC2(C)OCCO2)n1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 1/20 0.41
CACNA1G O43497 5/20 0.35
KCNH2 Q12809 2/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
FPR2 P25090 3/20 0.33
HRH3 Q9Y5N1 1/20 0.31
GSK3B P49841 2/20 0.31
FPR3 P25089 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
SCHEMBL1705940 0.86 CES1 (0.36) DAGLAFPR2HRH3FPR3
SCHEMBL1705958 0.85 FPR2 (0.31) DAGLAFPR2HRH3
SCHEMBL1705726 0.79 DAGLA (0.51) DAGLACACNA1GKCNH2SLC6A2SLC6A4
SCHEMBL19590777 0.77 DAGLA (0.45) DAGLACACNA1GKCNH2SLC6A2SLC6A4
SCHEMBL1706339 0.73 DAGLA (0.43) DAGLACACNA1GKCNH2SLC6A2SLC6A4
SCHEMBL18685939 0.73 DAGLA (0.43) DAGLACACNA1GKCNH2SLC6A2SLC6A4
SCHEMBL16011533 0.73 DAGLA (0.43) DAGLACACNA1GKCNH2SLC6A2SLC6A4
SCHEMBL2116168 0.71 DAGLA (0.43) DAGLACACNA1GKCNH2SLC6A2SLC6A4
SCHEMBL16130104 0.71 DAGLA (0.43) DAGLACACNA1GKCNH2SLC6A2SLC6A4
SCHEMBL19595758 0.71 DAGLA (0.41) DAGLACACNA1GKCNH2SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102803237-B Oxazole and thiazole derivatives as alx receptor agonists ACTELION PHARMACEUTICALS LTD 2014-09-24 CN disclosed
US-8674111-B2 Oxazole and thiazole derivatives as ALX receptor agonists ACTELION PHARMACEUTICALS LTD. (CH) 2014-03-18 US disclosed
EP-2440536-B1 Oxazole and thiazole derivatives as ALX receptor agonists ACTELION PHARMACEUTICALS LTD (CH) 2013-11-06 EP disclosed
CN-102803237-A Oxazole and thiazole derivatives as alx receptor agonists ACTELION PHARMACEUTICALS LTD 2012-11-28 CN disclosed
US-20120115916-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-05-10 US disclosed
EP-2440536-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS ALX RECEPTOR AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-04-18 EP disclosed
WO-2010143158-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-12-16 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-20120115916-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS ALX RECEPTOR AGONISTS P2RX1, GLP1R, P2RX7 DAGLA 3893/4885CACNA1G 777/4885KCNH2 2177/4885

“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.