SCHEMBL6281877

SCHEMBL6281877

CCOCc1nc2c(N)nc(C)c(C)c2n1C(C)C1CCN(S(C)(=O)=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 5/20 0.33
TLR8 Q9NR97 3/20 0.32
CCNE1 P24864 3/20 0.31
CDK2 P24941 3/20 0.31
CDK4 P11802 2/20 0.31
CCND1 P24385 2/20 0.31
CDK6 Q00534 2/20 0.31
NUDT1 P36639 1/20 0.31
CCNT1 O60563 1/20 0.30
CDK9 P50750 1/20 0.30
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CCNE2 O96020 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
SCHEMBL4301136 0.81 CDK2 (0.38) TLR7TLR8CCNE1CDK2CDK4
SCHEMBL6281876 0.80 TLR7 (0.38) TLR7TLR8CCNE1CDK2CDK4
SCHEMBL6780878 0.74 TLR7 (0.36) TLR7TLR8NUDT1
SCHEMBL6780316 0.73 TLR7 (0.38) TLR7TLR8NUDT1HTT
SCHEMBL6284763 0.70 ALDH1A1 (0.39) TLR7TLR8NUDT1
SCHEMBL6783346 0.70 TLR7 (0.38) TLR7TLR8NUDT1HTTL3MBTL1
SCHEMBL4305036 0.69 CCNE1 (0.38) CCNE1CDK2CDK4CCND1CDK6
SCHEMBL6777762 0.69 TGFBR1 (0.37) TLR7TLR8NUDT1HTT
SCHEMBL4793853 0.69 TLR8 (0.42) TLR7TLR8NUDT1
SCHEMBL4393435 0.69 TLR7 (0.58) TLR7TLR8NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6878719-B2 Sulfonamido substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-04-12 US disclosed
EP-1453829-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2004-09-08 EP disclosed
US-20040147533-A1 Sulfonamido substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-07-29 US disclosed
US-6696465-B2 INDUCING BIOSYNTHESIS OF CYTOKINES; VIRAL AND NEOPLASTIC DISEASES 3M INNOVATIVE PROPERTIES COMPANY 2004-02-24 US disclosed
US-20040019076-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2004-01-29 US disclosed
WO-2003050117-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO disclosed
US-6525064-B1 Immune response modifiers; can induce the biosynthesis of various cytokines; 3M INNOVATIVE PROPERTIES COMPANY 2003-02-25 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 (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-20040147533-A1 Sulfonamido substituted imidazopyridines IRF3, EIF2AK2, MYD88 TLR7 52/4885TLR8 62/4885CCNE1 3055/4885
US-20040019076-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES IRF3, EIF2AK2, MYD88 TLR7 52/4885TLR8 62/4885CCNE1 3055/4885

“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.