SCHEMBL13721365

SCHEMBL13721365

CCc1nc2c(N)nc3ccccc3c2n1CCCCNS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 13/20 0.74
▸ TLR8 Q9NR97 2/20 0.51
▸ HTR7 P34969 4/20 0.44
▸ DRD2 P14416 3/20 0.44
▸ HTR2A P28223 3/20 0.44
▸ HTR6 P50406 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HTR1A P08908 1/20 0.44

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
SCHEMBL14516468 0.92 TLR7 (0.63) TLR7TLR8
SCHEMBL3979207 0.91 TLR7 (0.82) TLR7TLR8
SCHEMBL13721794 0.89 TLR7 (0.59) TLR7TLR8
SCHEMBL14516464 0.87 TLR7 (0.63) TLR7TLR8
SCHEMBL18429392 0.86 TLR7 (0.86) TLR7TLR8
Cpg-52852 SCHEMBL483385 0.85 TLR7 (1.00) TLR7TLR8
SCHEMBL18680036 0.85 TLR7 (0.85) TLR7TLR8
Cpg-52852 SCHEMBL29371102 0.85 TLR7 (1.00) TLR7TLR8
SCHEMBL3970939 0.84 TLR7 (0.70) TLR7TLR8
SCHEMBL13722028 0.83 TLR7 (0.82) TLR7TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1642580-B1 Sulfonamide substituted imidazoquinolines COLEY PHARM GROUP INC (US) 2009-08-19 — — EP disclosed
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