SCHEMBL5348190

SCHEMBL5348190

Cc1nc2c(Oc3ccccc3)nc3c(c2n1CCCCSC(C)C)CCCC3

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
BCHE P06276 7/20 0.32
ACHE P22303 2/20 0.32
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
HTT P42858 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
SCHEMBL5368947 0.85 BCHE (0.36) BCHEACHELMNATP53HTT
SCHEMBL5355562 0.84 BCHE (0.32) BCHEACHELMNATP53HTT
SCHEMBL5406199 0.80 BCHE (0.32) BCHEACHELMNATP53HTT
SCHEMBL5366471 0.77 HTT (0.35) BCHEACHELMNAHTT
SCHEMBL5399354 0.76 TLR8 (0.35) BCHEACHE
SCHEMBL5348192 0.74 ADORA3 (0.33) NPC1RAB9ABCHEACHELMNA
SCHEMBL6700923 0.73 MAPT (0.36) BCHEACHE
SCHEMBL4793497 0.70 LMNA (0.36) LMNATP53HTT
SCHEMBL5355565 0.70 POLB (0.33) BCHEACHEHTT
SCHEMBL6486089 0.70 BCHE (0.33) BCHEACHELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276515-B2 Thioether substituted imidazoquinolines COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-10-02 US disclosed
US-6949649-B2 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES CO. (US) 2005-09-27 US disclosed
US-20050209268-A1 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2005-09-22 US disclosed
EP-1451191-A1 THIOETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2004-09-01 EP disclosed
US-20040097736-A1 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-05-20 US disclosed
US-6667312-B2 Useful as immune response modifiers 3M INNOVATIVE PROPERTIES COMPANY 2003-12-23 US disclosed
WO-2003050121-A1 THIOETHER SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO disclosed
US-20030100764-A1 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-05-29 US 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 (3 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-20050209268-A1 Thioether substituted imidazoquinolines IFNG, IRF3, IL2 NPC1 2837/4885RAB9A 3309/4885BCHE 4028/4885
US-20040097736-A1 Thioether substituted imidazoquinolines IFNG, IRF3, IL2 NPC1 2837/4885RAB9A 3309/4885BCHE 4028/4885
US-20030100764-A1 Thioether substituted imidazoquinolines IFNG, IRF3, IL2 NPC1 2837/4885RAB9A 3309/4885BCHE 4028/4885

“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.