SCHEMBL28758495

SCHEMBL28758495

CCN(CC)CCNCCOC(=O)NC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.36
CHRM2 P08172 6/20 0.35
CHRM1 P11229 4/20 0.35
CHRM3 P20309 4/20 0.35
CHRM4 P08173 3/20 0.35
CHRM5 P08912 1/20 0.35
KDM4E B2RXH2 1/20 0.33
BCHE P06276 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SLC22A1 O15245 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
POLB P06746 1/20 0.32
ACHE P22303 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL27645900 0.84 CYP2C9 (0.37) PAOXCHRM2CHRM1CHRM3CHRM4
SCHEMBL27872670 0.81 ACHE (0.38) ACHE
SCHEMBL28137724 0.78 KDM4E (0.37) KDM4EMEN1KMT2ALMNANPSR1
SCHEMBL28860189 0.77 CA12 (0.36) PAOXKDM4EMEN1KMT2ALMNA
SCHEMBL28244485 0.72 GAA (0.37) KDM4EPOLBACHE
SCHEMBL27766308 0.72 ACHE (0.35) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL21016721 0.72 ACHE (0.42) KDM4EMEN1KMT2AACHESMN1; SMN2
Bicarbonate SCHEMBL30077224 0.71 PAOX (0.50) PAOXKDM4EMEN1KMT2ASLC22A1
SCHEMBL27993979 0.71 SAT1 (0.41) MEN1KMT2ASMN1; SMN2CYP2D6
SCHEMBL25595752 0.71 CHRNB2 (0.50) CHRM2CHRM1CHRM3CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1917873-A Diurea derivatives ACTIVE BIOTECH AB (SE) 2007-02-21 CN disclosed