SCHEMBL14579757

SCHEMBL14579757

Cn1c(-c2cc(-c3nc4c5cccnc5c5ncccc5c4n3C)cc(-c3nc4c5cccnc5c5ncccc5c4n3C)c2)nc2c3cccnc3c3ncccc3c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 4/20 0.46
▸ CCR8 P51685 4/20 0.46
▸ L3MBTL1 Q9Y468 4/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ TLR7 Q9NYK1 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ SLC6A2 P23975 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ CCR5 P51681 2/20 0.38
▸ PSMD14 O00487 2/20 0.38
▸ COPS5 Q92905 2/20 0.38
▸ HCRTR1 O43613 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ COMT P21964 1/20 0.37

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
SCHEMBL14579763 0.93 CCR1 (0.43) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL14579756 0.92 L3MBTL1 (0.47) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL5486079 0.91 TLR7 (0.51) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL14579760 0.86 L3MBTL1 (0.47) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL14579758 0.86 CCR1 (0.47) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL14579765 0.85 L3MBTL1 (0.41) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL258866 0.85 CCR1 (0.42) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL14579764 0.84 NPC1 (0.40) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL2293902 0.84 CCR1 (0.46) CCR1CCR8L3MBTL1NPC1HSP90AA1
SCHEMBL2297542 0.83 NPC1 (0.44) CCR1CCR8L3MBTL1NPC1HSP90AA1

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
US-7179542-B2 Thiazole- and imidazole-fused phenanthroline molecules in organic light-emitting devices CANON KABUSHIKI KAISHA (JP) 2007-02-20 — — US disclosed
US-7179542-B2 Thiazole- and imidazole-fused phenanthroline molecules in organic light-emitting devices CANON KABUSHIKI KAISHA (JP) 2007-02-20 — — US disclosed
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