SCHEMBL5044307

SCHEMBL5044307

Cc1cc2[nH]ccc2o1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4415839 0.74 GPR84 (0.42)
SCHEMBL4427615 0.74 CYP1A2 (0.44)
SCHEMBL12907115 0.73
SCHEMBL5036715 0.73
SCHEMBL5039691 0.73
SCHEMBL13949500 0.72 MAOB (0.47)
SCHEMBL5042073 0.72 MEN1 (0.40)
SCHEMBL1238307 0.71 GSK3B (0.53)
SCHEMBL1170948 0.70 TLR8 (0.35)
SCHEMBL5044209 0.69 ALDH1A1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1715840-B1 KERATIN DYEING COMPOSITIONS CONTAINING BICYCLIC FUSED 5-5 HETEROAROMATIC DYES PROCTER & GAMBLE (US) 2008-12-03 EP claimed
US-7303590-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2007-12-04 US claimed
US-20050193502-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER, GAMBLE COMPANY, THE 2005-09-08 US claimed
US-9812315-B2 Treating solution for electronic parts, and process for producing electronic parts FINE POLYMERS CORPORATION (JP) 2017-11-07 US disclosed
EP-2022794-B1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME UNIV KEIO (JP) 2017-08-23 EP disclosed
US-20150279654-A1 TREATING SOLUTION FOR ELECTRONIC PARTS, AND PROCESS FOR PRODUCING ELECTRONIC PARTS FINE POLYMERS CORPORATION (JP) 2015-10-01 US disclosed
US-8193350-B2 Fluorescent compound and labeling agent comprising the same KEIO UNIVERSITY (JP) 2012-06-05 US disclosed
US-8193350-B2 Fluorescent compound and labeling agent comprising the same KEIO UNIVERSITY (JP) 2012-06-05 US disclosed
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same KEIO UNIVERSITY (JP) 2009-07-09 US disclosed
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same KEIO UNIVERSITY (JP) 2009-07-09 US disclosed
EP-2022794-A1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME Keio University (JP) 2009-02-11 EP disclosed
EP-1715840-B1 KERATIN DYEING COMPOSITIONS CONTAINING BICYCLIC FUSED 5-5 HETEROAROMATIC DYES PROCTER & GAMBLE (US) 2008-12-03 EP disclosed
US-7303590-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2007-12-04 US disclosed
EP-1715840-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF The Procter and Gamble Company (US) 2006-11-02 EP disclosed
US-20050193502-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER, GAMBLE COMPANY, THE 2005-09-08 US disclosed
WO-2005077324-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2005-08-25 WO disclosed