SCHEMBL5495402

SCHEMBL5495402

CCN(CO)C(=O)N1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.55
POLB P06746 1/20 0.47
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 1/20 0.40
DPP4 P27487 2/20 0.38
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 1/20 0.36
LIPE Q05469 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
SCHEMBL1858027 0.90 HTR1A (0.67) HTR1APOLBALDH1A1KDM4ELMNA
SCHEMBL12928358 0.87 HTR1A (0.69) HTR1APOLBALDH1A1KDM4ELMNA
SCHEMBL22350718 0.83 HTR1A (0.69) HTR1APOLBALDH1A1KDM4ELMNA
SCHEMBL196372 0.81 HTR1A (0.43) HTR1APOLBALDH1A1KDM4ELMNA
Alanine SCHEMBL28004622 0.78 HTR1A (0.53) HTR1APOLBALDH1A1KDM4ELMNA
SCHEMBL18918295 0.78 HTR1A (0.49) HTR1APOLBALDH1A1KDM4ELMNA
Alanine SCHEMBL27702084 0.76 HTR1A (0.55) HTR1APOLBALDH1A1KDM4ELMNA
SCHEMBL2160334 0.75 HTR1A (0.52) HTR1APOLBALDH1A1KDM4ELMNA
SCHEMBL29626142 0.75 HTR1A (0.44) HTR1APOLBALDH1A1KMT2ATDP1
SCHEMBL15904342 0.75 HRH3 (0.41) ALDH1A1MAPTTSHRKMT2ATDP1

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-1513814-A4 NOVEL PIPERIDINE COMPOUND TANABE SEIYAKU CO (JP) 2007-03-14 EP disclosed
EP-1513814-A1 NOVEL PIPERIDINE COMPOUND TANABE SEIYAKU CO., LTD. (JP) 2005-03-16 EP disclosed
WO-2003099787-A1 NOVEL PIPERIDINE COMPOUND TANABE SEIYAKU CO., LTD. (JP) 2003-12-04 WO disclosed