SCHEMBL18923200

SCHEMBL18923200

CCC[C@H](Nc1nc(N)nc2cccnc12)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 16/20 0.72
▸ TLR7 Q9NYK1 8/20 0.69
▸ KCNH2 Q12809 3/20 0.49

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
SCHEMBL18109496 0.91 TLR8 (0.87) TLR8TLR7KCNH2
SCHEMBL18109493 0.91 TLR8 (0.87) TLR8TLR7KCNH2
SCHEMBL18109695 0.89 TLR8 (0.70) TLR8TLR7KCNH2
SCHEMBL18109621 0.89 TLR8 (0.70) TLR8TLR7KCNH2
SCHEMBL18109622 0.89 TLR8 (0.70) TLR8TLR7KCNH2
SCHEMBL18109692 0.89 TLR8 (0.70) TLR8TLR7KCNH2
SCHEMBL18124772 0.87 TLR8 (0.61) TLR8TLR7KCNH2
SCHEMBL18109517 0.85 TLR8 (0.65) TLR8TLR7KCNH2
SCHEMBL18109514 0.85 TLR8 (0.65) TLR8TLR7KCNH2
SCHEMBL18109269 0.85 TLR8 (0.65) TLR8TLR7KCNH2

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
US-9670205-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2017-06-06 — — US disclosed
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