SCHEMBL5136457

SCHEMBL5136457

O=C(O)NCc1ccc(Cn2c(O)nc3c(Cl)nc4ccccc4c32)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 18/20 0.46
TLR8 Q9NR97 12/20 0.45
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 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
SCHEMBL213070 0.91 MEN1 (0.43) TLR7TLR8
SCHEMBL211223 0.87 TLR7 (0.51) TLR7TLR8
SCHEMBL212714 0.87 TLR7 (0.51) TLR7TLR8
SCHEMBL20766732 0.82 TLR7 (0.68) TLR7TLR8
SCHEMBL20448080 0.81 TLR7 (0.51) TLR7TLR8
SCHEMBL212885 0.81 TLR7 (0.53) TLR7ALDH1A1SMN1; SMN2
SCHEMBL213038 0.79 TLR7 (0.49) TLR7
SCHEMBL212611 0.78 TLR7 (0.51) TLR7TLR8ALDH1A1SMN1; SMN2
SCHEMBL26981129 0.75 TLR7 (0.65) TLR7TLR8
SCHEMBL30031494 0.75 TLR7 (0.57) TLR7TLR8

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
WO-2005082914-A2 MODULATORS OF LYSOPHOSPHATIDIC ACID (LPA) SIGNALING BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2005-09-09 WO claimed
EP-1948173-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS Coley Pharmaceutical Group, Inc. (US) 2008-07-30 EP disclosed
US-20080071116-A1 Modulators of Lysophosphatidic Acid (Lpa) Signaling and the Use Thereof THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-03-20 US disclosed
WO-2007056112-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-05-18 WO disclosed
WO-2005082914-A2 MODULATORS OF LYSOPHOSPHATIDIC ACID (LPA) SIGNALING BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2005-09-09 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-20080071116-A1 Modulators of Lysophosphatidic Acid (Lpa) Signaling and the Use Thereof LPAR4, LPAR2, LPAR6 TLR7 1221/4885TLR8 1726/4885ALDH1A1 2901/4885

“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.