SCHEMBL13324334

SCHEMBL13324334

Nc1cc(S(=O)(=O)O)cc2cc(SOOO)c(N=Nc3ccc(C=Cc4ccc(N=Nc5c(S(=O)(=O)O)cc6cc(SOOO)cc(N)c6c5O)cc4S(=O)(=O)O)cc3)c(O)c12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 6/20 0.46
▸ PHLPP2 Q6ZVD8 2/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ SENP2 Q9HC62 6/20 0.41
▸ SENP1 Q9P0U3 5/20 0.41
▸ SENP3 Q9H4L4 4/20 0.41
▸ SUMO2 P61956 4/20 0.41
▸ SUMO1 P63165 4/20 0.41
▸ SENP7 Q9BQF6 4/20 0.41
▸ CYP1A2 P05177 2/20 0.40
▸ PRMT1 Q99873 1/20 0.36
▸ CYP2C9 P11712 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ DNASE1L3 Q13609 1/20 0.34
▸ CD40 P25942 1/20 0.34
▸ CD40LG P29965 1/20 0.34
▸ PTPN11 Q06124 1/20 0.33

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
SCHEMBL13846673 0.96 ENPP2 (0.47) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL13597671 0.94 ENPP2 (0.45) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL13324335 0.91 ENPP2 (0.43) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL13846683 0.87 SENP2 (0.46) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL13597675 0.85 SENP2 (0.44) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL13324336 0.83 SENP2 (0.47) ENPP2PHLPP2SENP2SENP1SENP3
SCHEMBL9015266 0.82 MEN1 (0.60) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL16489079 0.82 MEN1 (0.60) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL13474895 0.82 MEN1 (0.60) ENPP2PHLPP2MEN1HTTKMT2A
SCHEMBL12955654 0.79 MEN1 (0.59) ENPP2PHLPP2MEN1HTTKMT2A

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-7708820-B2 Black ink composition, ink set containing the same, and ink jet recording method FUJIFILM CORPORATION (JP) 2010-05-04 — — US disclosed
US-20070240608-A1 Black Ink Composition, Ink Set Containing the Same, and Ink Jet Recording Method FUJIFILM CORPORATION (JP) 2007-10-18 — — US disclosed
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