SCHEMBL20145341

SCHEMBL20145341

C[C@H](F)CC[C@H](CO)Nc1nc(N)nc2cccnc12

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 17/20 0.79
▸ TLR7 Q9NYK1 8/20 0.79
▸ KCNH2 Q12809 3/20 0.46

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
SCHEMBL18124768 1.00 TLR8 (0.79) TLR8TLR7KCNH2
SCHEMBL18109694 1.00 TLR8 (0.79) TLR8TLR7KCNH2
SCHEMBL18109615 0.91 TLR8 (0.82) TLR8TLR7KCNH2
SCHEMBL18109612 0.91 TLR8 (0.82) TLR8TLR7KCNH2
SCHEMBL18109279 0.88 TLR8 (1.00) TLR8TLR7KCNH2
SCHEMBL18109277 0.88 TLR8 (1.00) TLR8TLR7KCNH2
SCHEMBL18124727 0.88 TLR8 (1.00) TLR8TLR7KCNH2
SCHEMBL18109625 0.87 TLR8 (0.83) TLR8TLR7KCNH2
SCHEMBL18109379 0.85 TLR8 (1.00) TLR8TLR7KCNH2
SCHEMBL18109380 0.85 TLR8 (1.00) 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
EP-3321265-A1 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS AND THEIR UTILISATION AS MODULATORS OF TOLL-LIKE RECEPTORS Gilead Sciences, Inc. (US) 2018-05-16 — — EP disclosed
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