SCHEMBL8986924

SCHEMBL8986924

CC[C@@H](C)P(=O)(O)COc1ccc(CC(C)N)cc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.47
TAAR1 Q96RJ0 3/20 0.42
SLC6A2 P23975 1/20 0.42
ADRB2 P07550 1/20 0.39
ADRB3 P13945 1/20 0.39
PTPN1 P18031 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
SCHEMBL8727070 0.84 PTPN1 (0.55) SLC6A4TAAR1SLC6A2ADRB2ADRB3
SCHEMBL8727063 0.84 PTPN1 (0.55) SLC6A4TAAR1SLC6A2ADRB2ADRB3
SCHEMBL8636517 0.83 SLC6A4 (0.50) SLC6A4TAAR1SLC6A2
SCHEMBL8986923 0.81 SLC6A4 (0.47) SLC6A4TAAR1SLC6A2
SCHEMBL8634785 0.78 SLC6A4 (0.47) SLC6A4TAAR1SLC6A2
SCHEMBL8634781 0.78 SLC6A4 (0.47) SLC6A4TAAR1SLC6A2
SCHEMBL8634784 0.78 SLC6A4 (0.47) SLC6A4TAAR1SLC6A2
SCHEMBL9062874 0.77 SLC6A4 (0.50) SLC6A4TAAR1SLC6A2
SCHEMBL8758035 0.77 ADRB3 (0.48) SLC6A4TAAR1SLC6A2ADRB3
SCHEMBL8732233 0.77 ADRB3 (0.48) SLC6A4TAAR1SLC6A2ADRB3

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