SCHEMBL8934773

SCHEMBL8934773

CC1Cc2ccccc2C(OCCN2CCCC(C(=O)O)C2)c2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 3/20 0.53

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
SCHEMBL9093092 0.91 KMT2A (0.45) SLC6A1
SCHEMBL8934775 0.88 SLC6A1 (0.53) SLC6A1
SCHEMBL9093322 0.88 LTA4H (0.47) SLC6A1
SCHEMBL8718182 0.87 SLC6A1 (0.59) SLC6A1
SCHEMBL8716102 0.87 SLC6A1 (0.65) SLC6A1
SCHEMBL8715983 0.82 SLC6A1 (0.66) SLC6A1
SCHEMBL8934806 0.82 SLC6A1 (0.53) SLC6A1
SCHEMBL9091831 0.81 DRD1 (0.36) SLC6A1
SCHEMBL9091737 0.80 SLC6A1 (0.45) SLC6A1
SCHEMBL8715371 0.80 SLC6A1 (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996031502-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1996-10-10 WO claimed
WO-1996031502-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1996-10-10 WO disclosed