SCHEMBL329433

SCHEMBL329433

CCc1cccc[n+]1C

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
SCHEMBL29729219 1.00
Hydrochloric Acid SCHEMBL30330872 0.98 HDAC8 (0.44)
Iodide SCHEMBL14633634 0.98 HDAC8 (0.44)
Hydrochloric Acid SCHEMBL2002518 0.98 HDAC8 (0.44)
Bromide SCHEMBL19063544 0.98 HDAC8 (0.44)
SCHEMBL30330597 0.93 HDAC8 (0.42)
SCHEMBL8505606 0.91 HDAC8 (0.40)
SCHEMBL29252923 0.86 HDAC8 (0.36)
SCHEMBL29252922 0.86 LMNA (0.41)
Acetic Acid SCHEMBL30330724 0.86 HDAC8 (0.36)

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 314 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946442-B2 Foamed ionic compounds E I DU PONT DE NEMOURS AND COMPANY (US) 2015-02-03 US claimed
EP-1812382-B1 METHOD FOR PRODUCING POLYISOCYANATES BASF SE (DE) 2013-01-23 EP claimed
WO-2012130803-A1 METHOD FOR SEPARATING OFF HALOGENS FROM MIXTURES OF MATTER BAYER TECHNOLOGY SERVICES GMBH (DE) 2012-10-04 WO claimed
JP-4794561-B2 2011-10-19 JP claimed
US-7659430-B2 Method for separating hydrogen chloride and phosgene BASF AKTIENGESELLSCHAFT (DE) 2010-02-09 US claimed
EP-1789160-B1 METHOD FOR SEPARATING HYDROGEN CHLORIDE AND PHOSGENE BASF SE (DE) 2009-11-18 EP claimed
US-20090112017-A1 METHOD FOR PRODUCING POLYISOCYANATES BASF AKTIENGESSELLSCHAFT (DE) 2009-04-30 US claimed
US-20070293707-A1 Method for Separating Hydrogen Chloride and Phosgene BASF AKTIENGESELLSCHAFT (DE) 2007-12-20 US claimed
WO-2007088152-A1 PROCESS FOR PREPARING ISOCYANATES BASF SE (DE) 2007-08-09 WO claimed
EP-1789160-A1 METHOD FOR SEPARATING HYDROGEN CHLORIDE AND PHOSGENE BASF AKTIENGESELLSCHAFT (DE) 2007-05-30 EP claimed
EP-1663921-B1 METHOD FOR PRODUCING HALOALKANES FROM ALCOHOLS BASF AG (DE) 2007-05-02 EP claimed
US-20070055084-A1 Method for producing haloalkanes from alcohols BASF AKTIENGESELLSCHAFT (DE) 2007-03-08 US claimed
EP-1663921-A2 METHOD FOR PRODUCING HALOALKANES FROM ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2006-06-07 EP claimed
WO-2006029788-A1 METHOD FOR SEPARATING HYDROGEN CHLORIDE AND PHOSGENE BASF AKTIENGESELLSCHAFT (DE) 2006-03-23 WO claimed
WO-2005026089-A2 METHOD FOR PRODUCING HALOALKANES FROM ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2005-03-24 WO claimed
JP-1047015-A None JP disclosed
JP-1047013-A None JP disclosed
JP-S6447015-A ELECTROLYTE FOR ELECTROLYTIC CONDENSER NIPPON CHEMICON 1989-02-21 JP disclosed
US-4237016-A NONIONIC SOFTENING AGENT AND A POLYMERIC CATIONIC SALT THE PROCTER & GAMBLE COMPANY (US) 1980-12-02 US disclosed
EP-0002085-A2 Textile conditioning compositions with low content of cationic guar gum THE PROCTER &amp; GAMBLE COMPANY (US) 1979-05-30 EP disclosed