SCHEMBL6486089

SCHEMBL6486089

Cc1nc2c(Oc3ccccc3)nc3c(c2n1C(S)CCCC(C)(C)C)CCCC3

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCHE P06276 13/20 0.33
ACHE P22303 13/20 0.33
HSD17B10 Q99714 1/20 0.33
HRH3 Q9Y5N1 1/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL6483879 0.85 ACHE (0.33) BCHEACHEHRH3KDM4EPOLB
SCHEMBL5406203 0.77 HSD17B10 (0.32) BCHEACHEHSD17B10POLBL3MBTL1
SCHEMBL5348192 0.75 ADORA3 (0.33) BCHEACHEKDM4EPOLBL3MBTL1
SCHEMBL5355565 0.74 POLB (0.33) BCHEACHEHSD17B10KDM4EPOLB
SCHEMBL5368947 0.71 BCHE (0.36) BCHEACHELMNAHTT
SCHEMBL6477156 0.71 HTT (0.33) BCHEPOLBLMNAHTT
SCHEMBL5406199 0.70 BCHE (0.32) BCHEACHEHSD17B10HRH3POLB
SCHEMBL5355562 0.69 BCHE (0.32) BCHEACHEPOLBLMNAHTT
SCHEMBL5366471 0.64 HTT (0.35) BCHEACHEPOLBLMNAHTT
SCHEMBL6700923 0.64 MAPT (0.36) BCHEACHEHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949649-B2 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES CO. (US) 2005-09-27 US disclosed
US-20040097736-A1 Thioether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-05-20 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 (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-20040097736-A1 Thioether substituted imidazoquinolines IFNG, IRF3, IL2 BCHE 4028/4885ACHE 4781/4885HSD17B10 3698/4885

“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.