SCHEMBL6686532

SCHEMBL6686532

Cc1c(C=CC=C2C(=O)N(c3ccc(S(=O)(=O)O)cc3)N=C2C(=O)O)c(O)n(-c2ccccc2)c(=O)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 1/20 0.44
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ MAPT P10636 9/20 0.38
▸ KMT2A Q03164 9/20 0.38
▸ ALDH1A1 P00352 7/20 0.38
▸ MAPK1 P28482 6/20 0.38
▸ HTT P42858 5/20 0.38
▸ L3MBTL1 Q9Y468 4/20 0.38
▸ POLB P06746 4/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ KAT8 Q9H7Z6 2/20 0.37
▸ MEN1 O00255 7/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.37
▸ MDM2 Q00987 1/20 0.37
▸ GPR55 Q9Y2T6 1/20 0.37
▸ HPGD P15428 2/20 0.37

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
SCHEMBL6678877 0.88 CA1 (0.39) TDP2CA1CA2CA9MAPT
SCHEMBL6683237 0.88 CA1 (0.47) TDP2CA1CA2CA9MAPT
SCHEMBL6683234 0.88 CA1 (0.47) TDP2CA1CA2CA9MAPT
SCHEMBL7049875 0.87 CA1 (0.46) TDP2CA1CA2CA9MAPT
SCHEMBL7049871 0.87 CA1 (0.46) TDP2CA1CA2CA9MAPT
SCHEMBL7869793 0.87 CA1 (0.46) TDP2CA1CA2CA9MAPT
SCHEMBL6680080 0.83 MAPT (0.47) CA1CA2CA9MAPTKMT2A
SCHEMBL6680081 0.83 MAPT (0.47) CA1CA2CA9MAPTKMT2A
Potassium Ion SCHEMBL7049873 0.80 CA1 (0.46) CA1CA2CA9MAPTKMT2A
SCHEMBL6680815 0.77 CA1 (0.35) CA1CA2CA9MAPTKMT2A

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-1033965-B1 AGENTS AND METHOD FOR PRODUCING SEMI-PERMANENT COLORATIONS OF KERATIN FIBERS WELLA AG (DE) 2004-11-24 — — EP claimed
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
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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