SCHEMBL23472109

SCHEMBL23472109

CCCCNc1nc(C)ncc1OCCOC(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 7/20 0.38
▸ TLR7 Q9NYK1 5/20 0.38
▸ KDM4E B2RXH2 5/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ GBA1 P04062 1/20 0.36
▸ GAA P10253 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ TP53 P04637 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.34

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
SCHEMBL13195832 0.86 L3MBTL1 (0.49) TLR8TLR7L3MBTL1
SCHEMBL23472288 0.85 TLR8 (0.38) TLR8TLR7KDM4ECYP3A4L3MBTL1
SCHEMBL20219396 0.85 TLR8 (0.35) TLR8TLR7KDM4EALDH1A1CYP3A4
SCHEMBL23472526 0.82 TLR8 (0.47) TLR8TLR7KDM4EALDH1A1HPGD
SCHEMBL23472623 0.81 LMNA (0.42) TLR8TLR7ALDH1A1GAAL3MBTL1
SCHEMBL20219723 0.80 ALDH1A1 (0.38) TLR8TLR7ALDH1A1FLT3TYRO3
SCHEMBL20219572 0.80 CYP2D6 (0.43) TLR8TLR7KDM4EALDH1A1NPC1
SCHEMBL20219391 0.80 TLR8 (0.35) TLR8TLR7KDM4EALDH1A1CYP3A4
SCHEMBL20219386 0.79 SCN9A (0.36) TLR8TLR7KDM4EALDH1A1HPGD
SCHEMBL20219304 0.79 TLR8 (0.36) TLR8TLR7CYP3A4L3MBTL1TSHR

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