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Sugi Predict / Compounds / SCHEMBL13239131

SCHEMBL13239131

SCHEMBL13239131

Cc1cc(S(=O)(=O)O)c(/N=N/c2c(C(=O)O)nn(-c3ccc(S(=O)(=O)O)cc3)c2O)cc1N=Nc1c(S(=O)(=O)O)cc2c(S(=O)(=O)O)c(N=Nc3cc(S(=O)(=O)O)c4cc(SOOO)c(N=Nc5ccc([N+](=O)[O-])cc5S(=O)(=O)O)c(O)c4c3N)ccc2c1O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 1/20 0.32
▸ ENPP2 Q13822 2/20 0.30

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
SCHEMBL13239113 0.98 PHLPP2 (0.32) PHLPP2ENPP2
SCHEMBL13239129 0.95 ENPP2 (0.31) ENPP2
SCHEMBL13239118 0.95 ENPP2 (0.31) ENPP2
SCHEMBL13239134 0.94 ENPP2 (0.30) ENPP2
SCHEMBL13239108 0.94 CD40 (0.36) ENPP2
SCHEMBL13239124 0.93 ENPP2 (0.34) ENPP2
SCHEMBL13387534 0.93 CD40 (0.34) ENPP2
SCHEMBL13265419 0.93 PHLPP2 (0.36) PHLPP2ENPP2
SCHEMBL13239111 0.93 ENPP2 (0.34) ENPP2
SCHEMBL13239133 0.92 ENPP2 (0.32) ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7758683-B2 Ink composition, ink set and recording method FUJIFILM CORPORATION (JP) 2010-07-20 — — US disclosed
US-7704311-B2 Ink composition, manufacturing method of ink, ink set, and recording method FUJIFILM CORPORATION (JP) 2010-04-27 — — US disclosed
US-20070109376-A1 Ink composition, ink set and recording method FUJIFILM CORPORATION 2007-05-17 — — US disclosed
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