SCHEMBL5481354

SCHEMBL5481354

COc1ccc(-c2cccc(CCCN3CCN(C(=O)O)CC3)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.61
DRD2 P14416 2/20 0.57
HRH2 P25021 1/20 0.51
HRH1 P35367 1/20 0.51
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
LMNA P02545 2/20 0.51
MAPT P10636 2/20 0.51
RECQL P46063 1/20 0.51
HTR2A P28223 1/20 0.47

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
SCHEMBL5487080 0.92 SIGMAR1 (0.66) SIGMAR1DRD2KDM4EALDH1A1MEN1
SCHEMBL5475896 0.88 SIGMAR1 (0.58) SIGMAR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL5490036 0.85 MEN1 (0.55) SIGMAR1DRD2HRH2HRH1KDM4E
SCHEMBL2176110 0.83 HRH2 (0.53) SIGMAR1DRD2HRH2HRH1KMT2A
SCHEMBL5480249 0.81 MEN1 (0.61) SIGMAR1MEN1KMT2ALMNA
SCHEMBL5477755 0.81 FAAH (0.57) SIGMAR1DRD2MEN1KMT2A
SCHEMBL5480169 0.79 SIGMAR1 (0.62) SIGMAR1HRH1KDM4EALDH1A1HTR2A
SCHEMBL5483514 0.78 MEN1 (0.60) SIGMAR1MEN1KMT2ALMNA
SCHEMBL13624854 0.78 SIGMAR1 (0.71) SIGMAR1DRD2KDM4EALDH1A1
SCHEMBL25284745 0.77 DRD2 (0.88) SIGMAR1DRD2KDM4EALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720848-B1 DERIVATIVES OF ALKYLPIPERAZINE- AND ALKYLHOMOPIPERAZINE- CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2007-12-05 EP claimed
EP-1720848-B1 DERIVATIVES OF ALKYLPIPERAZINE- AND ALKYLHOMOPIPERAZINE- CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2007-12-05 EP disclosed