SCHEMBL7049522

SCHEMBL7049522

O=C(O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1=CC=Cc1c(C(=O)O)nn(-c2ccc(S(=O)(=O)O)cc2)c1O.[Na].[Na].[Na].[Na]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 1/20 0.45
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ KAT8 Q9H7Z6 2/20 0.37
▸ ALDH1A1 P00352 7/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ KMT2A Q03164 8/20 0.35
▸ MAPT P10636 7/20 0.35
▸ MAPK1 P28482 6/20 0.35
▸ L3MBTL1 Q9Y468 6/20 0.35
▸ MEN1 O00255 6/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TDP1 Q9NUW8 4/20 0.34
▸ HTT P42858 4/20 0.34
▸ POLB P06746 4/20 0.34
▸ LMNA P02545 2/20 0.34
▸ NPSR1 Q6W5P4 3/20 0.33
▸ MDM2 Q00987 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
SCHEMBL6679067 1.00 TDP2 (0.45) TDP2CA1CA2CA9KAT8
SCHEMBL14207867 1.00 TDP2 (0.45) TDP2CA1CA2CA9KAT8
SCHEMBL9180471 1.00 TDP2 (0.45) TDP2CA1CA2CA9KAT8
SCHEMBL3184820 1.00 TDP2 (0.45) TDP2CA1CA2CA9KAT8
SCHEMBL13292949 1.00 TDP2 (0.45) TDP2CA1CA2CA9KAT8
SCHEMBL7051942 0.99 TDP2 (0.44) TDP2CA1CA2CA9KAT8
SCHEMBL6680138 0.96 TDP2 (0.43) TDP2CA1CA2CA9KAT8
SCHEMBL10038347 0.96 TDP2 (0.43) TDP2CA1CA2CA9KAT8
SCHEMBL6680130 0.96 TDP2 (0.43) TDP2CA1CA2CA9KAT8
SCHEMBL6679289 0.95 TDP2 (0.43) TDP2CA1CA2CA9KAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980236-B1 COLOURANT AND METHOD FOR PRODUCING TEMPORARY HAIR COLOURS WELLA AG (DE) 2003-04-23 — — EP claimed
US-6361571-B1 USING TAUTOMERIC NONOXIDATIVE DYES AND POLYMETHINE DYES WELLA AKTIENGESELLSCHAFT (DE) 2002-03-26 — — US claimed
US-6312478-B1 TWO COMPONENT KIT; ONE COMPONENT IS A COLORANT COMPRISING A MONOMETHINE OR POLYMETHINE DYE; SECOND COMPONENT CONSISTING OF A DECOLORIZING AGENT WELLA AKTIENGESELLSCHAFT (DE) 2001-11-06 — — US claimed
EP-0980236-B1 COLOURANT AND METHOD FOR PRODUCING TEMPORARY HAIR COLOURS WELLA AG (DE) 2003-04-23 — — EP disclosed
US-6361571-B1 USING TAUTOMERIC NONOXIDATIVE DYES AND POLYMETHINE DYES WELLA AKTIENGESELLSCHAFT (DE) 2002-03-26 — — US disclosed
US-6312478-B1 TWO COMPONENT KIT; ONE COMPONENT IS A COLORANT COMPRISING A MONOMETHINE OR POLYMETHINE DYE; SECOND COMPONENT CONSISTING OF A DECOLORIZING AGENT WELLA AKTIENGESELLSCHAFT (DE) 2001-11-06 — — US disclosed
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