SCHEMBL6678545

SCHEMBL6678545

CC1=C(C#N)C(=O)N(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 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.31
▸ LMNA P02545 1/20 0.31

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
SCHEMBL6682468 1.00 PTPN1 (0.33) PTPN1MEN1MAPTKMT2AALDH1A1
SCHEMBL1305381 0.89 HPGD (0.36) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL13850302 0.89 HPGD (0.36) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL1305383 0.89 HPGD (0.36) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL12240030 0.86 HPGD (0.35) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL6683237 0.81 CA1 (0.47) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL6683234 0.81 CA1 (0.47) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL7869793 0.81 CA1 (0.46) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL7049875 0.81 CA1 (0.46) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL7049871 0.81 CA1 (0.46) MEN1MAPTKMT2AALDH1A1KDM4E

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 7 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-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-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
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