SCHEMBL5236758

SCHEMBL5236758

CNC1(CC=O)CN(c2ccc(-c3ccc(Cl)cc3)cn2)CCN1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.40
DGAT1 O75907 5/20 0.40
KCNH2 Q12809 5/20 0.40
MGLL Q99685 2/20 0.39
RAB9A P51151 1/20 0.37
CNR2 P34972 1/20 0.35
ME2 P23368 2/20 0.35
ME1 P48163 2/20 0.35
ME3 Q16798 2/20 0.35
DYRK1A Q13627 1/20 0.34
PANK3 Q9H999 1/20 0.34
DRD2 P14416 1/20 0.34
DEGS1 O15121 1/20 0.34
ADORA2A P29274 1/20 0.34
SLC6A7 Q99884 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
SCHEMBL5234755 0.94 EGLN1 (0.39) EGLN1DGAT1KCNH2MGLLRAB9A
SCHEMBL5231079 0.90 DGAT1 (0.39) DGAT1KCNH2MGLLCNR2ADORA2A
SCHEMBL5238354 0.88 MAPT (0.40) DGAT1KCNH2MGLL
SCHEMBL5235446 0.86 ALDH1A1 (0.37) DRD2
SCHEMBL5237009 0.86 DGAT1 (0.39) DGAT1KCNH2CNR2
SCHEMBL5238953 0.86 TEK (0.37) PANK3
SCHEMBL5238526 0.85 PANK3 (0.39) RAB9APANK3DRD2
SCHEMBL5238848 0.83 EGLN1 (0.42) EGLN1DGAT1ME2ME1ME3
SCHEMBL5237586 0.83 KDM4E (0.40) DGAT1KCNH2MGLLCNR2
SCHEMBL5239098 0.82 MEN1 (0.39) DRD2

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
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed