SCHEMBL5024697

SCHEMBL5024697

CCc1ccc(CN(CC)CCN(Cc2ccc(CC)cn2)Cc2ccc(CC)cn2)nc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LIN28A Q9H9Z2 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.37
MCHR1 Q99705 1/20 0.36

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
SCHEMBL9908275 0.91 HRH3 (0.46) HRH3CYP1A2CYP2D6MAPTKMT2A
SCHEMBL5025697 0.87 KMT2A (0.47) HRH3CYP1A2CYP2D6MAPTSMN1; SMN2
SCHEMBL6865800 0.85 KDM4E (0.41) HRH3CYP1A2CYP2D6MAPTSMN1; SMN2
SCHEMBL5023073 0.85 KMT2A (0.49) HRH3CYP1A2CYP2D6MAPTSMN1; SMN2
SCHEMBL5027192 0.83 KMT2A (0.39) HRH3CYP1A2CYP2D6MAPTSMN1; SMN2
SCHEMBL825256 0.81 TDP1 (0.43) MAPTSMN1; SMN2LIN28ATDP1KDM4E
SCHEMBL7143514 0.80 KMT2A (0.42) HRH3CYP1A2CYP2D6MAPTSMN1; SMN2
SCHEMBL11955565 0.78 HRH3 (0.47) HRH3CYP1A2CYP2D6MAPTKMT2A
SCHEMBL15483889 0.78 HRH3 (0.39) HRH3CYP1A2CYP2D6MAPTTDP1
SCHEMBL487617 0.75 HRH3 (0.55) HRH3CYP1A2CYP2D6MAPTSMN1; SMN2

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 54 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-1341893-B1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER NV (NL) 2007-05-02 EP 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-1109884-B1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2004-09-01 EP disclosed
EP-1109965-A1 METHOD OF TREATING A TEXTILE 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
US-6165963-A Detergent bleaching composition comprising pentadentate ligand derivatives UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. (US) 2000-12-26 US disclosed
US-6140294-A OXIDATION CATALYST COMPRISING AN IRON, MANGANESE OR COPPER COMPLEX INCLUDING A SPECIFIED PENTADENTATE NITROGEN-CONTAINING LIGAND UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. (US) 2000-10-31 US disclosed
WO-2000060043-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2000-10-12 WO disclosed
EP-1008645-A1 Detergent bleaching compositions UNILEVER PLC (GB) 2000-06-14 EP disclosed
WO-2000027976-A1 BLEACH AND OXIDATION CATALYST UNILEVER PLC (GB) 2000-05-18 WO disclosed
WO-2000027975-A1 DETERGENT BLEACHING COMPOSITION UNILEVER PLC (GB) 2000-05-18 WO disclosed
WO-2000012808-A1 METHOD OF TREATING A TEXTILE UNILEVER PLC (GB) 2000-03-09 WO disclosed