SCHEMBL7049309

SCHEMBL7049309

O=C(Nc1ccccc1)c1ccc2c(N=Nc3ccc4c(c3)C(=O)c3cc(N=Nc5c(O)c(C(=O)Nc6ccccc6)cc6cc(C(=O)Nc7ccccc7)ccc56)ccc3-4)c(O)c(C(=O)Nc3ccccc3)cc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NQO2 P16083 1/20 0.59
▸ ACE2 Q9BYF1 1/20 0.43
▸ MAPK14 Q16539 1/20 0.41
▸ PLAU P00749 4/20 0.40
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ MAPT P10636 4/20 0.40
▸ POLB P06746 4/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ ENPP2 Q13822 1/20 0.40
▸ HTT P42858 2/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ PLEC Q15149 1/20 0.39
▸ F2 P00734 1/20 0.39
▸ PLG P00747 1/20 0.39
▸ PLAT P00750 1/20 0.39
▸ KLKB1 P03952 1/20 0.39
▸ KLK1 P06870 1/20 0.39
▸ PRSS1 P07477 1/20 0.39

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
SCHEMBL11913771 0.90 NQO2 (0.66) NQO2ACE2PLAUMEN1KMT2A
SCHEMBL13060095 0.90 NQO2 (0.66) NQO2ACE2PLAUMEN1KMT2A
SCHEMBL7049279 0.90 NQO2 (0.71) NQO2PLAUMEN1KMT2AMAPT
SCHEMBL14460170 0.88 NQO2 (0.70) NQO2PLAUMEN1KMT2AMAPT
SCHEMBL8397459 0.85 NQO2 (0.63) NQO2MEN1KMT2AMAPTPOLB
SCHEMBL7051391 0.84 NQO2 (0.64) NQO2PLAUMEN1KMT2AMAPT
SCHEMBL8401202 0.84 NQO2 (0.64) NQO2PLAUMEN1KMT2AMAPT
SCHEMBL7049501 0.83 NQO2 (0.58) NQO2PLAUMEN1KMT2AMAPT
SCHEMBL10864085 0.82 NQO2 (0.56) NQO2MAPK14PLAUMEN1KMT2A
SCHEMBL10863984 0.82 NQO2 (0.56) NQO2PLAUMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882767-B1 BISAZO COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF UENO SEIYAKU OYO KENKYUJO KK (JP) 2003-04-16 — — EP disclosed
US-5965715-A Bisazo compounds and process for the preparation thereof KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1999-10-12 — — US disclosed
EP-0882767-A1 BISAZO COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1998-12-09 — — EP disclosed
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