SCHEMBL8716102

SCHEMBL8716102

O=C(O)C1CCCN(CCOC2c3ccccc3CCc3ccccc32)C1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 2/20 0.65

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
SCHEMBL8718182 0.93 SLC6A1 (0.59) SLC6A1
SCHEMBL8715983 0.88 SLC6A1 (0.66) SLC6A1
SCHEMBL8934806 0.87 SLC6A1 (0.53) SLC6A1
SCHEMBL8934775 0.87 SLC6A1 (0.53) SLC6A1
SCHEMBL8934773 0.87 SLC6A1 (0.53) SLC6A1
SCHEMBL8718619 0.86 LTA4H (0.52) SLC6A1
SCHEMBL8715371 0.85 SLC6A1 (0.62) SLC6A1
SCHEMBL8715436 0.85 SLC6A1 (0.47) SLC6A1
SCHEMBL7471275 0.84 SLC6A1 (0.55) SLC6A1
SCHEMBL8859090 0.84 SLC6A1 (0.70) SLC6A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0825984-A1 NOVEL METHOD NOVO NORDISK A/S (DK) 1998-03-04 EP claimed
WO-1996031471-A1 NOVEL METHOD NOVO NORDISK A/S (DK) 1996-10-10 WO claimed
EP-0825984-A1 NOVEL METHOD NOVO NORDISK A/S (DK) 1998-03-04 EP disclosed
WO-1996031471-A1 NOVEL METHOD NOVO NORDISK A/S (DK) 1996-10-10 WO disclosed