SCHEMBL12028027

SCHEMBL12028027

Cc1ccc(/N=N/c2c(N)ccc3c(O)c(N=Nc4ccc(S(=O)(=O)O)cc4C(=O)O)c(S(=O)(=O)O)cc23)c(C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ ENPP2 Q13822 7/20 0.47
▸ SENP3 Q9H4L4 3/20 0.47
▸ SENP2 Q9HC62 3/20 0.47
▸ SENP1 Q9P0U3 3/20 0.47
▸ SUMO2 P61956 2/20 0.47
▸ SUMO1 P63165 2/20 0.47
▸ SENP7 Q9BQF6 2/20 0.47
▸ PHLPP2 Q6ZVD8 3/20 0.45
▸ MEN1 O00255 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CYP2C9 P11712 2/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ CYP1A2 P05177 2/20 0.41
▸ PTPN11 Q06124 1/20 0.41
▸ CD40 P25942 1/20 0.41
▸ CD40LG P29965 1/20 0.41

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
SCHEMBL12028000 0.94 ENPP2 (0.49) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL12028007 0.92 ALDH1A1 (0.46) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL12027998 0.88 ENPP2 (0.57) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL12028008 0.83 ENPP2 (0.57) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL12028010 0.79 PHLPP2 (0.55) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL14400893 0.78 CYP1A2 (0.42) ALDH1A1HIF1AENPP2PHLPP2MEN1
SCHEMBL13764102 0.77 ENPP2 (0.46) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL9342682 0.75 PHLPP2 (0.44) ALDH1A1HIF1AENPP2PHLPP2MEN1
SCHEMBL9339350 0.75 PHLPP2 (0.44) ALDH1A1HIF1AENPP2PHLPP2MEN1
SCHEMBL9342690 0.75 PHLPP2 (0.44) ALDH1A1HIF1AENPP2PHLPP2MEN1

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-8465577-B2 Blue, red, and yellow dye compounds, and black ink composition comprising the same EVERLIGHT USA, INC. (US) 2013-06-18 — — US disclosed
US-20110308425-A1 BLUE, RED, AND YELLOW DYE COMPOUNDS, AND BLACK INK COMPOSITION COMPRISING THE SAME EVERLIGHT USA, INC. (US) 2011-12-22 — — US disclosed
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