SCHEMBL360546

SCHEMBL360546

CC(C)C(C(=O)O)N(CC(=O)O)C(C)C.CC(C)C(C(=O)O)N(CC(=O)O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.33
MMP9 P14780 4/20 0.33
MMP1 P03956 3/20 0.33
MMP8 P22894 3/20 0.33
MMP14 P50281 2/20 0.33
ADAMTS4 O75173 1/20 0.33
GABRR1 P24046 2/20 0.32
CYP1A2 P05177 1/20 0.32
EYA2 O00167 1/20 0.32
APP P05067 1/20 0.32
ACE P12821 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MMP13 P45452 3/20 0.31
MMP3 P08254 2/20 0.31
MMP16 P51512 1/20 0.31
ADAM17 P78536 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
SCHEMBL4962362 1.00 MMP2 (0.33) MMP2MMP9MMP1MMP8MMP14
SCHEMBL867976 0.81 TDP1 (0.41) CYP1A2EYA2APPACETDP1
SCHEMBL23222802 0.80 ADAMTS4 (0.34) MMP2MMP9MMP1MMP8MMP14
Hydrochloric Acid SCHEMBL5577032 0.79 TDP1 (0.39) CYP1A2EYA2APPACETDP1
SCHEMBL562830 0.72 FFAR3 (0.38) CYP1A2EYA2APPACETDP1
SCHEMBL14502984 0.70 GABRR1 (0.36) MMP2MMP9MMP1MMP8ADAMTS4
SCHEMBL28253560 0.69 GABRP (0.33)
SCHEMBL28117498 0.69 GABRP (0.33)
SCHEMBL3791234 0.69 TP53 (0.38) MMP2MMP9MMP8MMP14ADAMTS4
SCHEMBL186528 0.69 TDP1 (0.39) CYP1A2EYA2APPACETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2453927-B1 LOADING TECHNIQUE FOR PREPARING RADIONUCLIDE AND IONOPHORE CONTAINING LIPOSOMES IN WHICH THE IONOPHORE IS 2-HYDROXYQUIONOLINE (CARBOSTYRIL) OR STRUCTURALLY RELATED 2-HYDROXYQUINOLINES UNIV DENMARK TECH DTU (DK) 2019-05-15 EP disclosed
US-20150202336-A1 Loading Technique for Preparing Radionuclide Containing Nanoparticles RIGSHOSPITALET (DK) 2015-07-23 US disclosed
US-8920775-B2 Loading technique for preparing radionuclide containing nanoparticles TECHNICAL UNIVERSITY OF DENMARK (DK) 2014-12-30 US disclosed
US-20130204121-A1 NANOPARTICLE-GUIDED RADIOTHERAPY TECHNICAL UNIVERSITY OF DENMARK (DK) 2013-08-08 US disclosed
EP-2593186-A1 NANOPARTICLE-GUIDED RADIOTHERAPY Technical University of Denmark (DK) 2013-05-22 EP disclosed
US-20120213698-A1 LOADING TECHNIQUE FOR PREPARING RADIONUCLIDE CONTAINING NANOPARTICLES RIGSHOSPITALET (DK) 2012-08-23 US disclosed
EP-2453927-A1 LOADING TECHNIQUE FOR PREPARING RADIONUCLIDE AND IONOPHORE CONTAINING LIPOSOMES IN WHICH THE IONOPHORE IS 2-HYDROXYQUIONOLINE (CARBOSTYRIL) OR STRUCTURALLY RELATED 2-HYDROXYQUINOLINES Technical University of Denmark (DK) 2012-05-23 EP disclosed
WO-2012007567-A1 NANOPARTICLE-GUIDED RADIOTHERAPY TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-01-19 WO disclosed
WO-2011006510-A1 LOADING TECHNIQUE FOR PREPARING RADIONUCLIDE AND IONOPHORE CONTAINING LIPOSOMES IN WHICH THE IONOPHORE IS 2-HYDROXYQUIONOLINE (CARBOSTYRIL) OR STRUCTURALLY RELATED 2-HYDROXYQUINOLINES TECHNICAL UNIVERSITY OF DENMARK (DK) 2011-01-20 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 (2 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-20150202336-A1 Loading Technique for Preparing Radionuclide Containing Nanoparticles LIPG, NPC1L1, CD47 MMP2 2927/4885MMP9 1216/4885MMP1 834/4885
US-20120213698-A1 LOADING TECHNIQUE FOR PREPARING RADIONUCLIDE CONTAINING NANOPARTICLES LIPG, NPC1L1, CD47 MMP2 2927/4885MMP9 1216/4885MMP1 834/4885

“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.