SCHEMBL27677960

SCHEMBL27677960

c1ccc2c(-n3cnc4ccccc43)c3ccccc3nc2c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.61
▸ POLB P06746 1/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ FGFR1 P11362 3/20 0.50
▸ MAPT P10636 2/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ ROCK1 Q13464 1/20 0.49
▸ MKNK1 Q9BUB5 1/20 0.49
▸ MKNK2 Q9HBH9 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ PTK2B Q14289 1/20 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
SCHEMBL30524297 0.90 HTT (0.62) HTTPOLBMAPK1FGFR1MAPT
SCHEMBL24514401 0.80 HTT (0.55) HTTPOLBMAPK1FGFR1MAPT
SCHEMBL5240404 0.78 HTT (0.56) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL24988386 0.77 HTT (0.60) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL13826706 0.77 HTT (0.60) HTTPOLBMAPK1FGFR1MAPT
SCHEMBL157265 0.76 HTT (1.00) HTTFGFR1
Benzene SCHEMBL14876970 0.76 HTT (1.00) HTTFGFR1
SCHEMBL9025863 0.76 PIK3CB (0.68) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL30955935 0.75 HCAR1 (0.56) HTTPOLBMAPK1FGFR1ROCK1
SCHEMBL2186557 0.75 HCAR1 (0.56) HTTPOLBMAPK1FGFR1ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101016292-A 9-(1-Benzimidazolyl)acridine CuI complex, preparing method and application thereof UNIV NANKAI (CN) 2007-08-15 — — CN claimed
CN-101016292-A 9-(1-Benzimidazolyl)acridine CuI complex, preparing method and application thereof UNIV NANKAI (CN) 2007-08-15 — — CN disclosed
CN-101016292-A 9-(1-Benzimidazolyl)acridine CuI complex, preparing method and application thereof UNIV NANKAI (CN) 2007-08-15 — — CN disclosed
CN-101016292-A 9-(1-Benzimidazolyl)acridine CuI complex, preparing method and application thereof UNIV NANKAI (CN) 2007-08-15 — — CN disclosed
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