SCHEMBL8986920

SCHEMBL8986920

CCC(Oc1ccc(CC(C)N)cc1)P(=O)(O)CC

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.47
TAAR1 Q96RJ0 3/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A3 Q01959 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
SCHEMBL8986923 0.78 SLC6A4 (0.47) SLC6A4TAAR1SLC6A2
SCHEMBL8986924 0.75 SLC6A4 (0.47) SLC6A4TAAR1SLC6A2
SCHEMBL8636517 0.74 SLC6A4 (0.50) SLC6A4TAAR1SLC6A2
SCHEMBL9634266 0.74 SMN1; SMN2 (0.53)
SCHEMBL3123300 0.74 SLC6A4 (0.58) SLC6A4TAAR1SLC6A2SLC6A3
SCHEMBL21807707 0.74 SLC6A4 (0.58) SLC6A4TAAR1SLC6A2SLC6A3
SCHEMBL27987191 0.74 SLC6A4 (0.61) SLC6A4TAAR1SLC6A2SLC6A3
SCHEMBL27986772 0.74 SLC6A4 (0.61) SLC6A4TAAR1SLC6A2SLC6A3
SCHEMBL27986770 0.74 SLC6A4 (0.61) SLC6A4TAAR1SLC6A2SLC6A3
SCHEMBL8759586 0.73 SLC6A4 (0.49) SLC6A4TAAR1SLC6A2SLC6A3

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-0717746-A1 PHOSPHINIC ACID DERIVATIVES WITH ANTI-HYPER GLYCEMIC AND/OR ANTI-OBESITY ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1996-06-26 EP disclosed
WO-1995007284-A1 PHOSPHINIC ACID DERIVATIVES WITH ANTI-HYPER GLYCEMIC AND/OR ANTI-OBESITY ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1995-03-16 WO disclosed