SCHEMBL6683237

SCHEMBL6683237

CC1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1=CC=Cc1c(C)c(C#N)c(=O)n(-c2ccc(S(=O)(=O)O)cc2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ KAT8 Q9H7Z6 2/20 0.45
▸ MAPT P10636 9/20 0.43
▸ KMT2A Q03164 9/20 0.43
▸ ALDH1A1 P00352 8/20 0.43
▸ MAPK1 P28482 7/20 0.43
▸ L3MBTL1 Q9Y468 7/20 0.43
▸ MEN1 O00255 7/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ POLB P06746 6/20 0.42
▸ HTT P42858 5/20 0.42
▸ TDP1 Q9NUW8 4/20 0.42
▸ LMNA P02545 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ PKM P14618 2/20 0.38
▸ OPRK1 P41145 2/20 0.38
▸ RECQL P46063 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
SCHEMBL6683234 1.00 CA1 (0.47) CA1CA2CA9KAT8MAPT
SCHEMBL7869793 0.99 CA1 (0.46) CA1CA2CA9KAT8MAPT
SCHEMBL7049871 0.99 CA1 (0.46) CA1CA2CA9KAT8MAPT
SCHEMBL7049875 0.99 CA1 (0.46) CA1CA2CA9KAT8MAPT
Potassium Ion SCHEMBL7049873 0.92 CA1 (0.46) CA1CA2CA9KAT8MAPT
SCHEMBL6680080 0.88 MAPT (0.47) CA1CA2CA9KAT8MAPT
SCHEMBL6680081 0.88 MAPT (0.47) CA1CA2CA9KAT8MAPT
SCHEMBL6686532 0.88 TDP2 (0.44) CA1CA2CA9KAT8MAPT
SCHEMBL6680815 0.87 CA1 (0.35) CA1CA2CA9KAT8MAPT
SCHEMBL6680812 0.87 CA1 (0.35) CA1CA2CA9KAT8MAPT

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 14 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
EP-1033965-A2 AGENTS AND METHOD FOR PRODUCING SEMI-PERMANENT COLORATIONS OF KERATIN FIBERS Wella Aktiengesellschaft (DE) 2000-09-13 — — EP claimed
WO-1999059529-A2 AGENTS AND METHOD FOR PRODUCING SEMI-PERMANENT COLORATIONS OF KERATIN FIBERS WELLA AKTIENGESELLSCHAFT (DE) 1999-11-25 — — WO claimed
EP-1033965-B1 AGENTS AND METHOD FOR PRODUCING SEMI-PERMANENT COLORATIONS OF KERATIN FIBERS WELLA AG (DE) 2004-11-24 — — EP disclosed
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
EP-1033965-A2 AGENTS AND METHOD FOR PRODUCING SEMI-PERMANENT COLORATIONS OF KERATIN FIBERS Wella Aktiengesellschaft (DE) 2000-09-13 — — EP disclosed
EP-0980236-A1 COLOURANT AND METHOD FOR PRODUCING TEMPORARY HAIR COLOURS Wella Aktiengesellschaft (DE) 2000-02-23 — — EP disclosed
WO-1999059529-A2 AGENTS AND METHOD FOR PRODUCING SEMI-PERMANENT COLORATIONS OF KERATIN FIBERS WELLA AKTIENGESELLSCHAFT (DE) 1999-11-25 — — WO disclosed
WO-1999044569-A1 COLOURANT AND METHOD FOR PRODUCING TEMPORARY HAIR COLOURS WELLA AKTIENGESELLSCHAFT (DE) 1999-09-10 — — WO disclosed
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