SCHEMBL13112902

SCHEMBL13112902

Nc1ccc(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)cc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 7/20 0.56
▸ SENP2 Q9HC62 6/20 0.50
▸ SENP3 Q9H4L4 5/20 0.50
▸ SENP1 Q9P0U3 5/20 0.50
▸ SUMO2 P61956 4/20 0.50
▸ SUMO1 P63165 4/20 0.50
▸ SENP7 Q9BQF6 4/20 0.50
▸ HSD17B10 Q99714 3/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ PTGS2 P35354 1/20 0.47
▸ CYP2C19 P33261 1/20 0.45
▸ GLO1 Q04760 2/20 0.41
▸ P2RX3 P56373 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ENPP2 Q13822 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ PDE4A P27815 1/20 0.40

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
SCHEMBL4256120 0.85 PHLPP2 (0.64) PHLPP2SENP2SENP3SENP1SUMO2
SCHEMBL4256125 0.85 PHLPP2 (0.64) PHLPP2SENP2SENP3SENP1SUMO2
SCHEMBL9628366 0.82 SENP2 (0.52) PHLPP2SENP2SENP3SENP1SUMO2
SCHEMBL6648993 0.82 GLO1 (0.61) PHLPP2SENP2SENP3SENP1SUMO2
SCHEMBL13100906 0.79 ENPP2 (0.46) PHLPP2HSD17B10CYP2C9ALDH1A1PTGS1
SCHEMBL13100898 0.79 SENP2 (0.54) PHLPP2SENP2SENP3SENP1SUMO2
SCHEMBL9626878 0.79 SENP2 (0.52) PHLPP2SENP2SENP3SENP1SUMO2
SCHEMBL13112900 0.79 SENP2 (0.49) PHLPP2SENP2SENP3SENP1SUMO2
SCHEMBL342600 0.78 ALDH1A1 (0.62) PHLPP2HSD17B10CYP2C9ALDH1A1CYP2C19
SCHEMBL18162857 0.78 KMT2A (0.62) PHLPP2HSD17B10CYP2C9ALDH1A1PTGS1

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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