SCHEMBL7093038

SCHEMBL7093038

CC(N(C)Cc1ccccn1)N(Cc1ccccn1)Cc1ccccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 1/20 0.52
LIN28A Q9H9Z2 1/20 0.52
KCNA5 P22460 1/20 0.44
ALDH1A1 P00352 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 4/20 0.42
KDM4E B2RXH2 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
HRH1 P35367 1/20 0.40
HIF1A Q16665 1/20 0.40
LMNA P02545 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40

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
SCHEMBL7095634 0.91 TDP1 (0.57) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL12089127 0.85 TDP1 (0.55) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL10261336 0.83 MAPT (0.57) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL172599 0.81 TDP1 (0.50) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL8167442 0.80 MAPT (0.53) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL13995680 0.79 TDP1 (0.49) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL13995302 0.79 TDP1 (0.49) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL13995694 0.79 TDP1 (0.49) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL7035519 0.79 TSHR (0.49) TDP1SMN1; SMN2MAPTLIN28AKCNA5
SCHEMBL12088818 0.79 SMN1; SMN2 (0.52) TDP1SMN1; SMN2MAPTLIN28AKCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6653271-B2 Organic compound that forms a complex with a transition metal, such as N,N-bis(pyridin-2-yl-methyl)-1,1-bis(pyridin-2-yl)-1-aminoethane; free of peroxygen bleach or a peroxy-based or-generating bleach system. UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-25 US disclosed
US-20030045442-A1 Composition and method for bleaching a substrate UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-03-06 US disclosed
US-20020013246-A1 Composition and method for bleaching laundry fabrics UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-31 US disclosed
US-20020010121-A1 Bleaching and dye transfer inhibiting composition and method for laundry fabrics UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-24 US disclosed