SCHEMBL11298253

SCHEMBL11298253

CCN(CC(=O)O)C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
CCR6 P51684 1/20 0.49
PAX8 Q06710 1/20 0.49
PTGDR2 Q9Y5Y4 6/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TBXA2R P21731 1/20 0.44
PTGIR P43119 1/20 0.44
PTGDR Q13258 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL801192 0.90 CCR6 (0.54) ALDH1A1CCR6PAX8LMNAMAPK1
SCHEMBL16665613 0.90 ALDH1A1 (0.58) ALDH1A1CCR6PAX8PTGDR2LMNA
SCHEMBL13049197 0.88 CCR6 (0.50) ALDH1A1CCR6PAX8PTGDR2LMNA
SCHEMBL11307171 0.86 ALDH1A1 (0.47) ALDH1A1CCR6PAX8PTGDR2LMNA
SCHEMBL11605776 0.86 SLC6A2 (0.50) ALDH1A1CCR6PAX8PTGDR2LMNA
SCHEMBL4692471 0.86 ALDH1A1 (0.54) ALDH1A1CCR6PAX8LMNAMAPK1
Hydrochloric Acid SCHEMBL23354638 0.86 CCR6 (0.46) ALDH1A1CCR6PAX8PTGDR2LMNA
SCHEMBL13687190 0.85 LMNA (0.62) ALDH1A1CCR6PAX8PTGDR2LMNA
SCHEMBL2787581 0.85 CCR6 (0.50) ALDH1A1CCR6PAX8LMNAMAPK1
SCHEMBL24821066 0.85 CCR6 (0.54) ALDH1A1CCR6PAX8LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12054485-B2 Substituted imidazoquinolines BioNTech SE (DE) 2024-08-06 US disclosed
EP-4403225-A2 SUBSTITUTED IMIDAZOQUINOLINES BioNTech SE (DE) 2024-07-24 EP disclosed
US-11987569-B2 Substituted imidazoquinolines as agonists of TLR7 BioNTech SE (DE) 2024-05-21 US disclosed
EP-3679038-B1 SUBSTITUTED IMIDAZOQUINOLINES BioNTech SE (DE) 2024-04-03 EP disclosed
CN-111132969-B Substituted imidazoquinolines as TLR7 agonists 生物技术公司 2024-01-30 CN disclosed
EP-4098652-A1 SUBSTITUTED IMIDAZOQUINOLINES AS AGONISTS OF TLR7 BioNTech SE (DE) 2022-12-07 EP disclosed
US-20220242845-A1 SUBSTITUTED IMIDAZOQUINOLINES AS AGONISTS OF TLR7 BioNTech SE (DE) 2022-08-04 US disclosed
US-20220227756-A1 SUBSTITUTED IMIDAZOQUINOLINES BioNTech SE (DE) 2022-07-21 US disclosed
EP-3679025-B1 SUBSTITUTED IMIDAZOQUINOLINES AS AGONISTS OF TLR7 BioNTech SE (DE) 2022-05-04 EP disclosed
US-11279684-B2 Substituted imidazoquinolines as agonists of TLR7 Bointech SE 2022-03-22 US disclosed
US-11267813-B2 Substituted imidazoquinolines BioNTech SE 2022-03-08 US disclosed
CN-111132969-A Substituted imidazoquinolines as TLR7 agonists 生物技术公司 2020-05-08 CN disclosed
CN-111094287-A Substituted imidazoquinolines 生物技术公司 2020-05-01 CN disclosed
US-4250085-A PHOSPHONATE-CONTAINING OLIGOPEPTIDES, BACTERICIDES HOFFMANN-LA ROCHE INC. (US) 1981-02-10 US disclosed
EP-0002822-A1 Phosphorus containing peptide derivatives, their production, intermediates for their production and pharmaceutical compositions containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1979-07-11 EP 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 (6 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-12054485-B2 Substituted imidazoquinolines TLR7, TLR3, TLR1 ALDH1A1 2446/4885CCR6 259/4885PAX8 3780/4885
US-11279684-B2 Substituted imidazoquinolines as agonists of TLR7 TLR7, TLR3, TLR1 ALDH1A1 2535/4885CCR6 432/4885PAX8 3421/4885
US-11987569-B2 Substituted imidazoquinolines as agonists of TLR7 TLR7, TLR3, TLR1 ALDH1A1 2535/4885CCR6 432/4885PAX8 3421/4885
US-11267813-B2 Substituted imidazoquinolines TLR7, TLR3, TLR1 ALDH1A1 2446/4885CCR6 259/4885PAX8 3780/4885
US-20220227756-A1 SUBSTITUTED IMIDAZOQUINOLINES TLR7, TLR3, TLR1 ALDH1A1 2446/4885CCR6 259/4885PAX8 3780/4885
US-20220242845-A1 SUBSTITUTED IMIDAZOQUINOLINES AS AGONISTS OF TLR7 TLR7, TLR3, TLR1 ALDH1A1 2535/4885CCR6 432/4885PAX8 3421/4885

“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.