SCHEMBL20219258

SCHEMBL20219258

CCCCNc1nc(N)ncc1CCCCc1ccc(C)c(OCC)c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 13/20 0.44
▸ TLR8 Q9NR97 8/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40

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
SCHEMBL20219768 0.88 TLR7 (0.47) TLR7TLR8L3MBTL1
SCHEMBL23472558 0.82 DHFR (0.51) —
SCHEMBL23472595 0.82 TLR8 (0.54) TLR7TLR8L3MBTL1
SCHEMBL20219671 0.82 DHFR (0.51) TLR7TLR8L3MBTL1
SCHEMBL20219607 0.81 TLR7 (0.52) TLR7TLR8L3MBTL1
SCHEMBL13195740 0.80 L3MBTL1 (0.57) TLR7TLR8L3MBTL1
SCHEMBL20219619 0.79 TLR7 (0.55) TLR7TLR8
SCHEMBL23472257 0.78 L3MBTL1 (0.58) TLR7TLR8L3MBTL1
SCHEMBL20219488 0.78 TLR7 (0.51) TLR7TLR8L3MBTL1
SCHEMBL23472602 0.78 TLR7 (0.47) TLR7TLR8L3MBTL1

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-3330257-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS Janssen Sciences Ireland UC (IE) 2018-06-06 — — EP disclosed
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