SCHEMBL203265

SCHEMBL203265

CC(C)(C)OC(=O)N1CCCn2c1nc1c(N)nc3cc(Br)ccc3c12

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 10/20 0.39
TLR8 Q9NR97 5/20 0.39
NLRP3 Q96P20 1/20 0.35
MAP4K4 O95819 2/20 0.34
MPO P05164 1/20 0.34
BACE1 P56817 3/20 0.33
HRH4 Q9H3N8 1/20 0.33
SSTR4 P31391 1/20 0.32

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
SCHEMBL4531052 0.85 MAPT (0.35) TLR7TLR8MPOBACE1HRH4
SCHEMBL1232779 0.83 TLR7 (0.38) TLR7TLR8NLRP3MAP4K4BACE1
SCHEMBL205088 0.83 BACE1 (0.34) BACE1
SCHEMBL1233856 0.79 MAP4K4 (0.40) TLR7TLR8NLRP3MAP4K4BACE1
SCHEMBL203622 0.76 BACE1 (0.33) BACE1
SCHEMBL202425 0.73 MAP4K4 (0.38) MAP4K4HRH4
SCHEMBL30074855 0.71 TLR7 (0.41) TLR7TLR8
SCHEMBL29036543 0.71 TLR7 (0.41) TLR7TLR8
SCHEMBL29036535 0.71 TRPV3 (0.40) BACE1SSTR4
SCHEMBL30074849 0.71 TRPV3 (0.40) BACE1SSTR4

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-8088788-B2 Substituted fused[1,2] imidazo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-03 US disclosed
US-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS PFIZER INC. 2009-09-03 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-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS IL2, IFNG, IL4 TLR7 69/4885TLR8 217/4885NLRP3 1502/4885

“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.