SCHEMBL9873989

SCHEMBL9873989

CCOC(=O)[C@H](O)[C@@H]1CCCN1C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.46
ACE P12821 3/20 0.45
LMNA P02545 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
CYP3A4 P08684 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
SLC6A1 P30531 2/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42

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
SCHEMBL10775425 0.89 ALDH1A1 (0.49) ALDH1A1L3MBTL1ACELMNANPSR1
SCHEMBL18297050 0.85 ALDH1A1 (0.46) ALDH1A1L3MBTL1ACELMNANPSR1
SCHEMBL10776986 0.85 PREP (0.55) ALDH1A1ACELMNA
SCHEMBL9872312 0.83 SLC6A1 (0.54) ALDH1A1L3MBTL1SLC6A1
SCHEMBL9872319 0.83 SLC6A1 (0.54) ALDH1A1L3MBTL1SLC6A1
SCHEMBL9873547 0.82 ALDH1A1 (0.45) ALDH1A1L3MBTL1SLC6A1
SCHEMBL9873550 0.82 ALDH1A1 (0.45) ALDH1A1L3MBTL1SLC6A1
SCHEMBL10771620 0.80 ALDH1A1 (0.47) ALDH1A1
SCHEMBL15723639 0.78 PIK3CD (0.58) ALDH1A1L3MBTL1NPSR1CYP3A4CYP2D6
SCHEMBL21715104 0.78 ALDH1A1 (0.63) ALDH1A1L3MBTL1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5051444-A Pyrrolidine derivatives as anti-amnesia agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-09-24 US disclosed