SCHEMBL14356002

SCHEMBL14356002

CN(C)C(=O)Nc1ccccc1N1CCNCC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 14/20 0.54
ADRB1 P08588 1/20 0.47
MAPT P10636 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GAA P10253 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL14355836 0.84 MAPK1 (0.60) MAPTNPSR1L3MBTL1GAAPOLB
SCHEMBL7537046 0.84 CHEK1 (0.54) CHEK1ADRB1MAPTNPSR1L3MBTL1
SCHEMBL1646808 0.82 CHEK1 (0.55) CHEK1ADRB1
SCHEMBL5558994 0.80 POLB (0.66) CHEK1MAPTNPSR1L3MBTL1GAA
SCHEMBL1646812 0.78 NPSR1 (0.51) CHEK1MAPTNPSR1L3MBTL1GAA
SCHEMBL5563711 0.78 SMN1; SMN2 (0.72) CHEK1MAPTNPSR1GAAPOLB
SCHEMBL14356004 0.78 KCNQ2 (0.55) CHEK1MAPTNPSR1L3MBTL1GAA
SCHEMBL6991512 0.78 CHEK1 (0.49) CHEK1ADRB1MAPTNPSR1L3MBTL1
SCHEMBL7833448 0.77 CHEK1 (0.50) CHEK1NPSR1L3MBTL1GAA
SCHEMBL8142012 0.77 MEN1 (0.56) MAPTNPSR1L3MBTL1GAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7291619-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-11-06 US disclosed
US-7291619-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-11-06 US disclosed