SCHEMBL5799486

SCHEMBL5799486

N#CC(O)C1CCN(C(=O)c2ccc(F)c(Cl)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.51
MGLL Q99685 10/20 0.50
FAAH O00519 1/20 0.47
TSHR P16473 1/20 0.44
HTR1A P08908 2/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL4512607 0.81 HSD11B1 (0.58) HSD11B1MGLLFAAHTSHRHPGD
SCHEMBL5777202 0.80 HTR1A (0.50) HTR1A
SCHEMBL2653348 0.76 HPGD (0.73) HSD11B1HTR1AHPGD
SCHEMBL2075037 0.76 HPGD (0.68) HSD11B1MGLLHTR1AHPGD
SCHEMBL5634046 0.74 HTR1A (0.49) HSD11B1MGLLHTR1A
SCHEMBL22406684 0.74 HPGD (0.55) HSD11B1MGLLHTR1AHPGD
SCHEMBL19971712 0.74 HTR1A (0.41) HTR1A
SCHEMBL5630460 0.72 HPGD (0.54) HSD11B1MGLLHTR1AHPGD
Methane SCHEMBL7459255 0.72 HTR1A (0.57) HTR1A
SCHEMBL19971721 0.71 HTR1A (0.58) HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358179-B1 SYNTHESIS METHOD AND INTERMEDIATES OF PYRIDIN-2-YL-METHYLAMINE PF MEDICAMENT (FR) 2006-05-10 EP disclosed
EP-1358179-A1 SYNTHESIS METHOD AND INTERMEDIATES OF PYRIDIN-2-YL-METHYLAMINE PIERRE FABRE MEDICAMENT (FR) 2003-11-05 EP disclosed
WO-2002064585-A1 SYNTHESIS METHOD AND INTERMEDIATES OF PYRIDIN-2-YL-METHYLAMINE PIERRE FABRE MEDICAMENT (FR) 2002-08-22 WO disclosed