SCHEMBL8715531

SCHEMBL8715531

O=C(O)CN1CCN(CCOC2c3ccccc3CCc3ccccc32)CC1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.44
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
KCNA5 P22460 2/20 0.41
LMNA P02545 1/20 0.41
HTR1A P08908 1/20 0.39
DRD3 P35462 1/20 0.39

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
SCHEMBL8718619 0.84 LTA4H (0.52)
SCHEMBL8712827 0.80 LTA4H (0.46)
SCHEMBL8715436 0.79 SLC6A1 (0.47)
SCHEMBL8716102 0.77 SLC6A1 (0.65)
SCHEMBL7682324 0.77 ALDH1A1 (0.53) HTR2C
SCHEMBL8717944 0.77 LTA4H (0.44)
SCHEMBL8718270 0.76 SLC6A1 (0.43)
SCHEMBL8714604 0.76 SLC6A1 (0.41) LMNA
SCHEMBL8715934 0.75 HDAC3 (0.37)
SCHEMBL8718701 0.73 SMN1; SMN2 (0.46)

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-0820442-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-01-28 EP disclosed
WO-1996031474-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1996-10-10 WO disclosed