SCHEMBL5236708

SCHEMBL5236708

CC(=O)C1(N)CN(c2ccc(-c3cccc(C(F)(F)F)c3)nc2)CCN1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.41
MAOB P27338 4/20 0.41
DHODH Q02127 1/20 0.41
MAOA P21397 3/20 0.40
CTSC P53634 1/20 0.39
KMO O15229 2/20 0.39
FYN P06241 2/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CG P48736 1/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
SLC6A7 Q99884 1/20 0.38
LMNA P02545 1/20 0.38
CNR2 P34972 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
JAK2 O60674 1/20 0.36
ATM Q13315 1/20 0.36
MET P08581 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
SCHEMBL5234118 0.86 DHODH (0.41) KDM1AMAOBDHODHMAOACTSC
SCHEMBL5236715 0.83 KDM1A (0.39) KDM1AMAOBDHODHMAOAKMO
SCHEMBL5234475 0.83 MGLL (0.48) MAPTSLC6A7SMN1; SMN2
SCHEMBL5234121 0.79 DHODH (0.39) KDM1AMAOBDHODHMAOACTSC
SCHEMBL5230452 0.79 SLC6A7 (0.49) KDM1AMAOBDHODHCTSCKMO
SCHEMBL5233237 0.73 SMN1; SMN2 (0.44) MAPTHPGDLMNAHTTSMN1; SMN2
SCHEMBL5232200 0.72 SLC6A7 (0.42) KDM1AMAOBMAOAMAPTHPGD
SCHEMBL594736 0.70 LMNA (0.50) KDM1AMAOBMAOAMAPTHPGD
SCHEMBL5231133 0.70 CNR2 (0.51) MAPTLMNACNR2SMN1; SMN2
SCHEMBL595155 0.70 ALDH1A1 (0.55) MAPTHPGDLMNAHTTSMN1; SMN2

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