SCHEMBL5233253

SCHEMBL5233253

O=C(O)N1CCCN(c2ccc(-c3ccc(OC(F)(F)F)cc3)cn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
POLB P06746 1/20 0.46
PANK3 Q9H999 2/20 0.44
PKM P14618 1/20 0.44
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
BACE1 P56817 2/20 0.43
DGAT2 Q96PD7 1/20 0.43
CACNA1G O43497 1/20 0.43
CACNA1H O95180 1/20 0.43
CACNA1I Q9P0X4 1/20 0.43
RET P07949 1/20 0.43
MGLL Q99685 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 1/20 0.42
SLC6A7 Q99884 1/20 0.41
EPHX2 P34913 1/20 0.41
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL5232866 0.95 PANK3 (0.47) KDM4EPANK3BCHEACHEBACE1
SCHEMBL5234185 0.85 KDM4E (0.59) KDM4EPOLBPKMMGLLSMN1; SMN2
SCHEMBL5238882 0.85 EGLN1 (0.51) KDM4EPOLBPKMCACNA1HMGLL
SCHEMBL593717 0.82 SMN1; SMN2 (0.48) KDM4EPOLBPANK3PKMBCHE
SCHEMBL5237235 0.81 MGLL (0.53) KDM4EPOLBPANK3MGLLSLC6A7
SCHEMBL31589961 0.80 EGLN1 (0.55) KDM4EPKMMGLLSMN1; SMN2HPGD
SCHEMBL5232948 0.80 MGLL (0.60) KDM4EPOLBPKMMGLLSMN1; SMN2
SCHEMBL5237745 0.78 MGLL (0.60) KDM4EPOLBPKMMGLLSMN1; SMN2
SCHEMBL5238137 0.78 KCNA5 (0.58) POLBSLC6A7EPHX2HRH2HRH1
SCHEMBL31589397 0.78 HTR1A (0.52) KDM4EPKMMGLLSLC6A7

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-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
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 disclosed
EP-1701946-A2 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME Sanofi-Aventis (FR) 2006-09-20 EP disclosed
WO-2005070910-A2 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI-AVENTIS (FR) 2005-08-04 WO disclosed