SCHEMBL3524748

SCHEMBL3524748

CC1(C)OC(=O)C(Cc2ccccc2)O1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TLR9 Q9NR96 1/20 0.41
CTRB1 P17538 1/20 0.39
MDM2 Q00987 4/20 0.39
ELANE P08246 2/20 0.38
FASN P49327 1/20 0.38
CTSG P08311 1/20 0.38
PRTN3 P24158 1/20 0.38
F2 P00734 2/20 0.36
PRSS1 P07477 2/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 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
SCHEMBL3524746 1.00 GLA (0.43) GLANPSR1TLR9CTRB1MDM2
SCHEMBL3994040 0.86 MEN1 (0.50) GLANPSR1
SCHEMBL5380212 0.86 MEN1 (0.50) GLANPSR1
SCHEMBL3990482 0.83 GLA (0.44) GLANPSR1
SCHEMBL5385235 0.83 GLA (0.44) GLANPSR1
SCHEMBL29097002 0.82 PLA2G6 (0.43) FASN
SCHEMBL7417047 0.79 GLA (0.66) GLANPSR1TLR9CTRB1MDM2
SCHEMBL25966683 0.78 CTRB1 (0.42) GLANPSR1TLR9CTRB1ELANE
SCHEMBL2252699 0.76 NPSR1 (0.43) NPSR1TSHR
SCHEMBL13804959 0.76 POLB (0.48) GLANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116217909-A Polymerization method of 1, 3-dioxolan-4-one compounds 华东理工大学 2023-06-06 CN disclosed
US-7807677-B2 HIV protease inhibitors MEDIVIR AB (SE) 2010-10-05 US disclosed
EP-1851193-B1 HIV PROTEASE INHIBITORS MEDIVIR AB (SE) 2009-04-22 EP disclosed
US-20080249102-A1 Hiv Protease Inhibitors MEDIVIR AB (SE) 2008-10-09 US disclosed
EP-1851193-A1 HIV PROTEASE INHIBITORS MEDIVIR AB (SE) 2007-11-07 EP disclosed
WO-2006084688-A1 HIV protease inhibitors MEDIVIR AB (SE) 2006-08-17 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-20080249102-A1 Hiv Protease Inhibitors SERPINB1, ANPEP, XPNPEP1 GLA 447/4885NPSR1 1505/4885TLR9 4709/4885

“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.