SCHEMBL17676121

SCHEMBL17676121

Cc1ccc(/N=N/c2c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(/N=N/c4ccc([N+](=O)[O-])cc4)c(N)c3c2O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 6/20 0.67
▸ THRB P10828 1/20 0.48
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ PTPN6 P29350 1/20 0.45
▸ PTPN11 Q06124 1/20 0.45
▸ PHLPP2 Q6ZVD8 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SUMO2 P61956 1/20 0.43

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
SCHEMBL10891731 0.95 ENPP2 (0.73) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL4461171 0.95 ENPP2 (0.73) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL13991376 0.92 ENPP2 (0.67) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL12631994 0.92 ENPP2 (0.69) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL10887734 0.92 ENPP2 (0.69) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL10887721 0.92 ENPP2 (0.69) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL1984266 0.91 ENPP2 (0.68) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL15497814 0.91 ENPP2 (0.68) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL3179864 0.91 ENPP2 (0.68) ENPP2THRBMEN1KMT2ACYP1A2
SCHEMBL29678423 0.91 ENPP2 (0.68) ENPP2THRBMEN1KMT2ACYP1A2

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-9310679-B2 Making lithographic printing plates EASTMAN KODAK COMPANY (US) 2016-04-12 — — US disclosed
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