Propane

Propane

SCHEMBL28428265

CCC.CS(=O)(=O)c1ccc(Cn2c(=O)[nH]c3c(N)nc(S(=O)O)nc32)cc1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.64
TLR8 Q9NR97 1/20 0.53

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
Propane SCHEMBL28675793 0.88 TLR7 (0.62) TLR7TLR8
Propane SCHEMBL28477001 0.87 TLR7 (0.65) TLR7
Propane SCHEMBL28428147 0.83 TLR7 (0.62) TLR7
Propane SCHEMBL28424662 0.82 TLR7 (0.63) TLR7TLR8
Propane SCHEMBL28422651 0.82 TLR7 (0.63) TLR7TLR8
Propane SCHEMBL28417406 0.81 TLR7 (0.59) TLR7TLR8
SCHEMBL18207367 0.80 TLR7 (0.67) TLR7TLR8
Propane SCHEMBL28426047 0.79 TLR7 (0.62) TLR7
SCHEMBL18207661 0.78 TLR7 (0.67) TLR7TLR8
SCHEMBL18207648 0.78 TLR7 (1.00) TLR7

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
CN-107580596-B Sulfimidoylpurine ketone compounds and derivatives for the treatment and prevention of viral infections 豪夫迈·罗氏有限公司 2020-07-14 CN disclosed