SCHEMBL5138863

SCHEMBL5138863

C=CCN(CC=C)CCN(CCN(CC=C)CC=C)C(n1cccn1)n1cccn1

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
SCHEMBL5140417 0.75 HSP90AA1 (0.32)
SCHEMBL8510883 0.73 NOS1 (0.30)
SCHEMBL6528243 0.66 OPRK1 (0.38)
SCHEMBL127488 0.64 TSHR (0.38)
SCHEMBL11577405 0.63
SCHEMBL3263290 0.62
SCHEMBL5138972 0.61 KCNA5 (0.43)
SCHEMBL27095801 0.61 KMT2A (0.35)
Hydrochloric Acid SCHEMBL9501246 0.61 OPRK1 (0.36)
SCHEMBL3260302 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7335629-B2 Support-fixed bleaching catalyst complex compounds suitable as catalysts for peroxygen compounds HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-02-26 US disclosed
EP-1456337-B1 USE OF SUPPORT-FIXED BLEACHING CATALYST COMPLEX COMPOUNDS AS CATALYSTS FOR PEROXIDE COMPOUNDS HENKEL KGAA (DE) 2007-01-24 EP disclosed
US-7049278-B2 Composition and method for bleaching a substrate UNILEVER HOME AND PERSONAL CARE USA DIVISION OF CONOPCO, INC. (US) 2006-05-23 US disclosed
EP-1409628-B1 LIQUID UNIT DOSE DETERGENT PRODUCT UNILEVER NV (NL) 2006-02-15 EP disclosed
EP-1360268-B1 BLEACHING COMPOSITION OF ENHANCED STABILITY AND A PROCESS FOR MAKING SUCH A COMPOSITION UNILEVER PLC (GB) 2006-01-04 EP disclosed
EP-1109965-B1 METHOD OF TREATING A TEXTILE UNILEVER PLC (GB) 2005-06-01 EP disclosed
US-20040266641-A1 Support-fixed bleaching catalyst complex compounds suitable as catalysts for peroxygen compounds HENKEL AG & CO. KGAA (DE) 2004-12-30 US disclosed
EP-1240302-B1 BLEACHING COMPOSITION UNILEVER NV (NL) 2004-09-29 EP disclosed
EP-1456337-A1 SUPPORT-FIXED BLEACHING CATALYST COMPLEX COMPOUNDS SUITABLE AS CATALYSTS FOR PEROXIDE COMPOUNDS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-09-15 EP disclosed
EP-1109884-B1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2004-09-01 EP disclosed
US-6340661-B1 FOR BLEACHING FABRIC STAINS WITHOUT UNACCEPTABLE TRANSFER OF DYES BETWEEN FABRICS UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-22 US disclosed
US-6302921-B1 NON PEROXY BLEACH UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2001-10-16 US disclosed
US-20010025019-A1 Bleaching composition UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2001-09-27 US disclosed
US-20010009271-A1 Bleaching composition UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2001-07-26 US disclosed
EP-1109965-A1 METHOD OF TREATING A TEXTILE UNILEVER PLC (GB) 2001-06-27 EP disclosed
EP-1109884-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-06-27 EP disclosed
US-6245115-B1 N,N-BIS(PYRIDIN-2-YL-METHYL)-1,1-BIS(PYRIDIN-2-YL)-1-AMINOETHA NE COMPLEX WITH ACETONITRILE AND PERCHLORIC ACID, WHEREBY THE COMPLEX CATALYSES BLEACHING OF THE TEXTILE BY ATMOSPHERIC OXYGEN UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2001-06-12 US disclosed
US-6242409-B1 PERCHLORATE IRON COMPLEX OF ACETONITRILE AND N,N-BIS(PYRIDIN-2-YL-METHYL)-1,1-BIS(PYRIDIN-2-YL)-1-AMINOETHA NE, THE COMPLEX CATALYSING BLEACHING OF A SUBSTRATE BY THE ATMOSPHERIC OXYGEN; PEROXY BLEACH FREE. UNILEVER HOME & PERSONAL CARE USA 2001-06-05 US disclosed
WO-2000012808-A1 METHOD OF TREATING A TEXTILE UNILEVER PLC (GB) 2000-03-09 WO disclosed
WO-2000012667-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2000-03-09 WO disclosed