SCHEMBL2843229

SCHEMBL2843229

O=C(O)NCCCCc1cc(-c2ccc(Cl)cc2)nc(C2CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.43
PDE4D Q08499 6/20 0.43
VCP P55072 3/20 0.40
MAPT P10636 2/20 0.38
CTRC Q99895 2/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
NAMPT P43490 1/20 0.36
PSD A5PKW4 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL2412263 0.83 FAAH (0.38) PDE4BPDE4DVCPMAPTCTRC
SCHEMBL2838220 0.83 CTRC (0.41) VCPMAPTCTRCTP53KDM4E
SCHEMBL2841068 0.82 CTRC (0.44) VCPMAPTCTRCTP53KDM4E
SCHEMBL2842751 0.80 CTRC (0.42) VCPMAPTCTRCTP53KDM4E
SCHEMBL2836839 0.79 CTRC (0.45) VCPMAPTCTRCTP53KDM4E
SCHEMBL2840908 0.78 KMO (0.50) MAPTCTRCTP53KDM4EHPGD
SCHEMBL2839899 0.74 KDM4E (0.45) VCPMAPTCTRCTP53KDM4E
SCHEMBL2842168 0.74 KMO (0.51) MAPTCTRCTP53KDM4EHPGD
SCHEMBL2839700 0.73 KDM4E (0.48) VCPMAPTCTRCTP53KDM4E
SCHEMBL2844564 0.73 NOTUM (0.55) MAPTTP53HPGDTDP1

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
EP-2251324-A1 HETEROARYL-ALKYLCARBAMATE COMPOUNDS AND THEIR USE AS INHIBITORS OF THE FAAH ENZYME Sanofi-Aventis (FR) 2010-11-17 EP disclosed
EP-1720829-B1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-10-14 EP disclosed
EP-1720829-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005090292-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2005-09-29 WO disclosed