SCHEMBL12559265

SCHEMBL12559265

O=S(=O)(O)c1cccc2c(S(=O)(=O)O)c(/N=N/c3ccc(Nc4nc(O)nc(Nc5ccc(/N=N/c6ccc7c(S(=O)(=O)O)cccc7c6S(=O)(=O)O)cc5)n4)cc3)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.47
▸ ATIC P31939 3/20 0.44
▸ ENPP2 Q13822 1/20 0.42
▸ CTRB1 P17538 1/20 0.41
▸ MEN1 O00255 4/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ BLM P54132 2/20 0.40
▸ NSD2 O96028 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ IDE P14735 1/20 0.40
▸ DUSP3 P51452 1/20 0.40
▸ CCR6 P51684 1/20 0.40
▸ FUT8 Q9BYC5 1/20 0.40
▸ THRB P10828 3/20 0.39
▸ SUMO2 P61956 2/20 0.39
▸ SUMO1 P63165 2/20 0.39
▸ SENP7 Q9BQF6 2/20 0.39
▸ SENP2 Q9HC62 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.38
▸ APP P05067 2/20 0.38

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
SCHEMBL16548546 0.95 CYP1A2 (0.46) CYP1A2ATICENPP2CTRB1MEN1
SCHEMBL13388793 0.91 CYP1A2 (0.40) CYP1A2ATICENPP2CTRB1MEN1
SCHEMBL12559264 0.87 SUMO2 (0.45) CYP1A2ATICENPP2CTRB1MEN1
SCHEMBL12559095 0.84 ATIC (0.47) CYP1A2ATICENPP2CTRB1MEN1
SCHEMBL14163968 0.82 FUT8 (0.67) CYP1A2ENPP2MEN1KMT2AFUT8
SCHEMBL13388949 0.80 ATIC (0.50) CYP1A2ATICENPP2CTRB1MEN1
SCHEMBL12559267 0.80 ATIC (0.51) CYP1A2ATICENPP2CTRB1MEN1
SCHEMBL14163926 0.79 FUT8 (0.62) CYP1A2ENPP2MEN1KMT2AFUT8
SCHEMBL12558914 0.78 SENP2 (0.62) CYP1A2ATICENPP2CTRB1MEN1
SCHEMBL13151895 0.78 KMT2A (0.43) ATICENPP2MEN1KMT2ANSD2

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
US-9587129-B2 Ink composition and ink set SEIKO EPSON CORPORATION (JP) 2017-03-07 — — US disclosed
US-20160137859-A1 INK COMPOSITION AND INK SET SEIKO EPSON CORPORATION (JP) 2016-05-19 — — US disclosed
US-20160032125-A1 INK SET SEIKO EPSON CORPORATION (JP) 2016-02-04 — — US disclosed
EP-1920008-B1 DISAZODYES FOR INK-JET PRINTING FUJIFILM IMAGING COLORANTS LTD (GB) 2011-06-15 — — EP disclosed
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