SCHEMBL20219563

SCHEMBL20219563

CCCCNc1nc(C)ncc1OCC(CC)OC

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 15/20 0.36
▸ TLR7 Q9NYK1 8/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33

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
SCHEMBL15470372 0.86 L3MBTL1 (0.48) TLR8TLR7L3MBTL1CYP3A4CYP1A2
SCHEMBL23472660 0.86 CYP1A2 (0.35) TLR8TLR7KDM4ENPSR1L3MBTL1
SCHEMBL20219391 0.86 TLR8 (0.35) TLR8TLR7KDM4ENPSR1L3MBTL1
SCHEMBL23472634 0.81 ALDH1A1 (0.35) TLR8TLR7KDM4ENPSR1L3MBTL1
SCHEMBL23472288 0.79 TLR8 (0.38) TLR8TLR7KDM4ENPSR1L3MBTL1
SCHEMBL20219396 0.77 TLR8 (0.35) TLR8TLR7KDM4ENPSR1L3MBTL1
SCHEMBL23472526 0.76 TLR8 (0.47) TLR8TLR7KDM4ENPSR1L3MBTL1
SCHEMBL23472109 0.76 TLR8 (0.38) TLR8TLR7KDM4ENPSR1L3MBTL1
SCHEMBL20219723 0.74 ALDH1A1 (0.38) TLR8TLR7ALDH1A1POLB
SCHEMBL20219512 0.73 TLR8 (0.38) TLR8TLR7KDM4ENPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3590928-B1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2021-06-09 — — EP disclosed
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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