SCHEMBL7580771

SCHEMBL7580771

O=S(=O)(O)c1cc[c]c2c(O)cccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 2/20 0.49
AURKA O14965 1/20 0.49
TTR P02766 1/20 0.43
COMT P21964 1/20 0.41
CDK2 P24941 1/20 0.41
CYP1A2 P05177 3/20 0.38
MPL P40238 4/20 0.36
MEN1 O00255 1/20 0.36
NSD2 O96028 1/20 0.36
POLB P06746 1/20 0.36
IDE P14735 1/20 0.36
DUSP3 P51452 1/20 0.36
CCR6 P51684 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
ATIC P31939 2/20 0.34
CTRB1 P17538 1/20 0.34
TNNI3 P19429 1/20 0.34
TNNT2 P45379 1/20 0.34
TNNC1 P63316 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
SCHEMBL7574224 0.86 COMT (0.49) AURKBAURKATTRCOMTCDK2
SCHEMBL6598756 0.86 TTR (0.50) AURKBAURKATTRCOMTCDK2
SCHEMBL1413154 0.79 TTR (0.34) AURKBAURKATTRCOMTCYP1A2
SCHEMBL7574819 0.77 CYP1A2 (0.39) AURKBAURKATTRCOMTCYP1A2
SCHEMBL7576088 0.77 NT5E (0.43) AURKBAURKACOMTCYP1A2MEN1
SCHEMBL6631749 0.77 TTR (0.43) AURKBAURKATTRCOMTCYP1A2
SCHEMBL6631055 0.75 HSD17B10 (0.44) CDK2CYP1A2MEN1POLBBLM
SCHEMBL5031748 0.74 TTR (0.53) AURKBAURKATTRCOMTCDK2
SCHEMBL31399765 0.74 CDK2 (0.70) AURKBAURKATTRCOMTCDK2
SCHEMBL30165664 0.74 CDK2 (0.70) AURKBAURKATTRCOMTCDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0979847-B1 WATER-SOLUBLE TRISAZO COMPOUNDS, AQUEOUS INK COMPOSITION AND COLORED ARTICLE NIPPON KAYAKU KK (JP) 2002-09-25 EP claimed
EP-0979847-A1 WATER-SOLUBLE TRISAZO COMPOUNDS, AQUEOUS INK COMPOSITION AND COLORED ARTICLE NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2000-02-16 EP claimed
EP-0514330-B1 Azodyes CIBA GEIGY AG (CH) 1996-07-17 EP claimed
US-5225545-A Colorfast CIBA-GEIGY CORPORATION (US) 1993-07-06 US claimed
EP-0514330-A1 Azodyes CIBA-GEIGY AG (CH) 1992-11-19 EP claimed
EP-0979847-B1 WATER-SOLUBLE TRISAZO COMPOUNDS, AQUEOUS INK COMPOSITION AND COLORED ARTICLE NIPPON KAYAKU KK (JP) 2002-09-25 EP disclosed
US-6409810-B1 STORAGE STABILITY; HIGH OPTICAL DENSITY; WATERPROOF AND LIGHT RESISTANCE; PENS; PRINTED IMAGES NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2002-06-25 US disclosed
EP-0979847-A1 WATER-SOLUBLE TRISAZO COMPOUNDS, AQUEOUS INK COMPOSITION AND COLORED ARTICLE NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2000-02-16 EP disclosed
EP-0514330-B1 Azodyes CIBA GEIGY AG (CH) 1996-07-17 EP disclosed
US-5225545-A Colorfast CIBA-GEIGY CORPORATION (US) 1993-07-06 US disclosed
EP-0514330-A1 Azodyes CIBA-GEIGY AG (CH) 1992-11-19 EP disclosed