SCHEMBL5333410

SCHEMBL5333410

CCCc1nc2c(N)ncc(C)c2n1CCCS(=O)(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSP90B1 P14625 2/20 0.40
TLR7 Q9NYK1 8/20 0.38
TLR8 Q9NR97 4/20 0.38
HSP90AA1 P07900 2/20 0.36
HSP90AB1 P08238 2/20 0.36
SLC40A1 Q9NP59 1/20 0.36
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
ERBB2 P04626 1/20 0.33

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
SCHEMBL5348326 0.97 HSP90B1 (0.40) HSP90B1TLR7TLR8HSP90AA1HSP90AB1
SCHEMBL5341324 0.96 HSP90B1 (0.39) HSP90B1TLR7TLR8HSP90AA1HSP90AB1
SCHEMBL5348006 0.96 TLR7 (0.43) HSP90B1TLR7TLR8
SCHEMBL5336979 0.93 TLR7 (0.43) HSP90B1TLR7TLR8
SCHEMBL5339370 0.93 HSP90B1 (0.41) HSP90B1TLR7TLR8HSP90AA1HSP90AB1
SCHEMBL4793984 0.92 TLR7 (0.42) HSP90B1TLR7TLR8
SCHEMBL4793673 0.91 HSP90B1 (0.39) HSP90B1TLR7TLR8SLC40A1KMT2A
SCHEMBL4791636 0.90 HSP90B1 (0.41) HSP90B1TLR7TLR8HSP90AA1HSP90AB1
SCHEMBL4793476 0.89 HSP90B1 (0.40) HSP90B1TLR7TLR8HSP90AA1HSP90AB1
SCHEMBL4794286 0.89 TLR7 (0.43) HSP90B1TLR7TLR8SLC40A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220758-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-22 US disclosed
US-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2006-11-09 US disclosed
US-7125890-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-10-24 US disclosed
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors 3M INNOVATIVE PROPERTIES COMPANY 2005-02-10 US disclosed
US-6797718-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-09-28 US disclosed
US-20040010007-A1 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-01-15 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-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES IL2, IL4, MYD88 HSP90B1 757/4885TLR7 33/4885TLR8 45/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP HSP90B1 403/4885TLR7 93/4885TLR8 91/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 HSP90B1 757/4885TLR7 33/4885TLR8 45/4885

“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.