SCHEMBL13112903

SCHEMBL13112903

O=Cc1ccc(C(=O)Nc2ccc(/N=N/c3cc(S(=O)(=O)O)ccc3S(=O)(=O)O)cc2C(=O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 3/20 0.42
▸ P2RX3 P56373 2/20 0.40
▸ ALB P02768 1/20 0.39
▸ TIMP3 P35625 2/20 0.39
▸ PHLPP2 Q6ZVD8 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ P2RX2 Q9UBL9 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SERPINE1 P05121 3/20 0.37
▸ CD40 P25942 1/20 0.35
▸ CD40LG P29965 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
SCHEMBL13100906 0.93 ENPP2 (0.46) ENPP2ALBTIMP3PHLPP2MAPT
SCHEMBL13113034 0.84 ENPP2 (0.48) ENPP2ALBTIMP3PHLPP2MAPT
SCHEMBL13112901 0.84 TIMP3 (0.43) ENPP2P2RX3ALBTIMP3PHLPP2
SCHEMBL13100912 0.76 ENPP2 (0.53) ENPP2ALBTIMP3PHLPP2MAPT
SCHEMBL13100902 0.76 TIMP3 (0.47) ENPP2P2RX3ALBTIMP3PHLPP2
SCHEMBL13112902 0.74 PHLPP2 (0.56) ENPP2P2RX3PHLPP2MEN1KMT2A
SCHEMBL13100900 0.72 TIMP3 (0.44) ENPP2P2RX3ALBTIMP3PHLPP2
SCHEMBL13100907 0.72 TIMP3 (0.46) ENPP2P2RX3ALBTIMP3PHLPP2
SCHEMBL13100897 0.72 ENPP2 (0.51) ENPP2P2RX3TIMP3MAPTMEN1
SCHEMBL13593480 0.70 ENPP2 (0.46) ENPP2P2RX3ALBTIMP3PHLPP2

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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