SCHEMBL3731360

SCHEMBL3731360

NC([C]=O)CSCC(O)CO

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL3424655 1.00 ALDH1A1 (0.32) ALDH1A1LMNA
SCHEMBL890790 0.76 LMNA (0.53) ALDH1A1LMNA
SCHEMBL13694503 0.74 LMNA (0.50) ALDH1A1LMNA
SCHEMBL1860323 0.74 LMNA (0.50) ALDH1A1LMNA
SCHEMBL17077897 0.73
SCHEMBL3731363 0.71 AKR1B1 (0.36) ALDH1A1LMNA
SCHEMBL1275073 0.71 ARG1 (0.48) ALDH1A1
SCHEMBL788419 0.71 ARG1 (0.48) ALDH1A1
SCHEMBL788420 0.71 ARG1 (0.48) ALDH1A1
SCHEMBL2056977 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9567336-B2 Conjugated TLR7 and/or TLR8 and TLR2 agonists INVIVOGEN (FR) 2017-02-14 US disclosed
EP-2769738-B1 Conjugated TLR7 and/or TLR8 and TLR2 polycationic agonists INVIVOGEN (FR) 2016-07-20 EP disclosed
EP-2732825-B1 Conjugates of a TLR7 and/or TLR8 agonist and a TLR2 agonist INVIVOGEN (FR) 2015-07-01 EP disclosed
EP-2769738-A1 Conjugated TLR7 and/or TLR8 and TLR2 polycationic agonists Invivogen (FR) 2014-08-27 EP disclosed
US-20140141033-A1 CONJUGATED TLR7 AND/OR TLR8 AND TLR2 AGONISTS CAYLA (FR) 2014-05-22 US disclosed
EP-2732825-A1 Conjugated TLR7 and/or TLR8 and TLR2 agonists Invivogen (FR) 2014-05-21 EP disclosed
US-7795223-B2 Treatment of inflammatory airway disease NOVOZYMES BIOPHARMA AU LTD. (AU) 2010-09-14 US disclosed
US-20080200394-A1 Treatment of Inflammatory Airway Disease GROPEP LIMITED (AU) 2008-08-21 US disclosed
EP-1755635-A1 TREATMENT OF INFLAMMATORY AIRWAY DISEASE GroPep Limited (AU) 2007-02-28 EP disclosed
WO-2005115430-A1 TREATMENT OF INFLAMMATORY AIRWAY DISEASE GROPEP LIMITED (AU) 2005-12-08 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-20140141033-A1 CONJUGATED TLR7 AND/OR TLR8 AND TLR2 AGONISTS TLR7, TLR8, TLR9 ALDH1A1 4696/4885LMNA 3188/4885

“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.