SCHEMBL1168752

SCHEMBL1168752

CCO[Si](CCCNC(=O)Oc1ccc(I)c(C(=O)O)c1)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.40

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
SCHEMBL15865940 0.97 MGLL (0.42) MGLL
SCHEMBL16919356 0.79 NPC1 (0.48) MGLL
SCHEMBL1169021 0.78 HCRTR1 (0.40) MGLL
SCHEMBL20226254 0.78 MGLL (0.50) MGLL
SCHEMBL20544861 0.76 CA12 (0.41) MGLL
SCHEMBL20226263 0.76 ESR1 (0.46) MGLL
SCHEMBL20226252 0.76 MGLL (0.58) MGLL
SCHEMBL1546308 0.75 MGLL (0.52) MGLL
SCHEMBL12979663 0.75 NPC1 (0.40)
SCHEMBL1546349 0.75 KMT2A (0.50)

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
US-8772197-B2 Compositions for chemical and biological defense MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-07-08 US disclosed
US-8772197-B2 Compositions for chemical and biological defense MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-07-08 US disclosed
US-20110027869-A1 Compositions for Chemical and Biological Defense MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2011-02-03 US disclosed
US-20110027869-A1 Compositions for Chemical and Biological Defense MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2011-02-03 US disclosed
WO-2009055128-A2 COMPOSITIONS FOR CHEMICAL AND BIOLOGICAL DEFENSE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-04-30 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-20110027869-A1 Compositions for Chemical and Biological Defense LPO, MPO, GPX4 MGLL 202/4885

“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.