SCHEMBL6952194

SCHEMBL6952194

CCN1CCN(N(C(C)=O)C(C)C)CCN(N(C(C)=O)C(C)C)CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
PIK3CD O00329 1/20 0.35
HSD11B1 P28845 3/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33

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
SCHEMBL6946356 0.75 SMN1; SMN2 (0.38) KDM4ESMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL1489507 0.73 CHRM2 (0.30) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL22152624 0.68 KDM4E (0.44) KDM4EPIK3CDHSD11B1ALDH1A1CHRM1
SCHEMBL7476130 0.66 SIGMAR1 (0.37) KDM4ESMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL27195608 0.65 SMN1; SMN2 (0.43) KDM4ESMN1; SMN2HSD11B1KMT2AMEN1
Sulfuric Acid SCHEMBL11764713 0.65 HSD11B1 (0.44) KDM4ESMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL17971054 0.65 MEN1 (0.48) KDM4ESMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL84934 0.65 PIK3CD (0.59) KDM4EPIK3CDHSD11B1
SCHEMBL12640341 0.65 MEN1 (0.48) KDM4ESMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL13060045 0.64 MAPT (0.50) KDM4EHSD11B1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6646122-B1 Triazacyclohenonane ligand UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-11 US claimed
EP-1259522-B1 LIGAND AND COMPLEX FOR CATALYTICALLY BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2003-09-10 EP claimed
US-6610641-B2 Transition metal complex UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-08-26 US claimed
US-6432900-B1 ANTISOILANTS UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-08-13 US claimed
US-20020010120-A1 Composition and method for bleaching a substrate UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-24 US claimed
US-6646122-B1 Triazacyclohenonane ligand UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-11 US disclosed
US-6646122-B1 Triazacyclohenonane ligand UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-11 US disclosed
EP-1259522-B1 LIGAND AND COMPLEX FOR CATALYTICALLY BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2003-09-10 EP disclosed
US-6610641-B2 Transition metal complex UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-08-26 US disclosed
US-6432900-B1 ANTISOILANTS UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-08-13 US disclosed
US-20020010120-A1 Composition and method for bleaching a substrate UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-24 US disclosed