SCHEMBL13113034

SCHEMBL13113034

O=Cc1ccc(C(=O)Nc2ccc(/N=N/c3ccc4cc(S(=O)(=O)O)cc(S(=O)(=O)O)c4c3)cc2C(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 5/20 0.48
▸ TIMP3 P35625 3/20 0.41
▸ APEX1 P27695 1/20 0.38
▸ ALB P02768 1/20 0.37
▸ SUMO2 P61956 1/20 0.37
▸ SUMO1 P63165 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP2 Q9HC62 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ SERPINE1 P05121 3/20 0.36
▸ USP2 O75604 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ PHLPP2 Q6ZVD8 1/20 0.35
▸ PPARG P37231 1/20 0.35

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
SCHEMBL13100912 0.93 ENPP2 (0.53) ENPP2TIMP3APEX1ALBSUMO2
SCHEMBL13112901 0.93 TIMP3 (0.43) ENPP2TIMP3ALBSUMO2SUMO1
SCHEMBL13100902 0.85 TIMP3 (0.47) ENPP2TIMP3APEX1ALBMEN1
SCHEMBL13112903 0.84 ENPP2 (0.42) ENPP2TIMP3ALBMEN1ALDH1A1
SCHEMBL13100907 0.81 TIMP3 (0.46) ENPP2TIMP3APEX1ALBMEN1
SCHEMBL13100900 0.81 TIMP3 (0.44) ENPP2TIMP3ALBMEN1ALDH1A1
SCHEMBL13100897 0.80 ENPP2 (0.51) ENPP2TIMP3APEX1MEN1ALDH1A1
SCHEMBL13593480 0.79 ENPP2 (0.46) ENPP2TIMP3APEX1ALBMEN1
SCHEMBL14257962 0.78 TIMP3 (0.41) ENPP2TIMP3APEX1ALBMEN1
SCHEMBL13100896 0.77 ENPP2 (0.47) ENPP2TIMP3MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100272896-A1 Ink-Jet Printing Process, Ink and Colorant FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-10-28 — — US disclosed
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