SCHEMBL4621769

SCHEMBL4621769

CCCCN1C[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1COCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 3/20 0.50
SSTR5 P35346 3/20 0.50
BCHE P06276 3/20 0.49
ACHE P22303 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.43
GBA1 P04062 2/20 0.41
UGCG Q16739 2/20 0.41
GBA2 Q9HCG7 2/20 0.41
LMNA P02545 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
SCHEMBL15721092 1.00 SSTR4 (0.50) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL20577640 1.00 SSTR4 (0.50) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL19575247 1.00 SSTR4 (0.50) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL7036228 0.98 BCHE (0.49) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL15721070 0.96 BCHE (0.53) SSTR4SSTR5BCHEACHEL3MBTL1
Bromide SCHEMBL28007848 0.95 BCHE (0.53) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL15721118 0.95 BCHE (0.55) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL15721151 0.95 BCHE (0.55) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL15721150 0.93 SSTR4 (0.49) SSTR4SSTR5BCHEACHEL3MBTL1
SCHEMBL19132634 0.91 BCHE (0.53) SSTR4SSTR5BCHEACHEL3MBTL1

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-1362031-B1 PHARMACEUTICALLY ACTIVE PIPERIDINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-03-19 EP disclosed