SCHEMBL10779003

SCHEMBL10779003

CCCOC(=O)C[C@@H](O)CCl

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NAAA Q02083 1/20 0.35
DGKA P23743 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL6155100 1.00 ALDH1A1 (0.36) ALDH1A1L3MBTL1NAAADGKAHCAR2
SCHEMBL6155108 0.89 NAAA (0.46) ALDH1A1L3MBTL1NAAADGKAHCAR2
SCHEMBL28472092 0.89 NAAA (0.46) ALDH1A1L3MBTL1NAAADGKAHCAR2
SCHEMBL27782449 0.89 NAAA (0.46) ALDH1A1L3MBTL1NAAADGKAHCAR2
SCHEMBL6155107 0.87 NAAA (0.40) ALDH1A1L3MBTL1NAAADGKAHCAR2
SCHEMBL16190579 0.85 NAAA (0.56) L3MBTL1NAAADGKAMAPTMAPK1
SCHEMBL10775492 0.85 NAAA (0.56) L3MBTL1NAAADGKAMAPTMAPK1
SCHEMBL10775538 0.85 NAAA (0.56) L3MBTL1NAAADGKAMAPTMAPK1
SCHEMBL9141966 0.85 NAAA (0.56) L3MBTL1NAAADGKAMAPTMAPK1
SCHEMBL10774536 0.85 NAAA (0.56) L3MBTL1NAAADGKAMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111592466-B Micro-reaction continuous flow synthesis method of levocarnitine 复旦大学 2022-08-19 CN disclosed
CN-111592466-A Micro-reaction continuous flow synthesis method of levocarnitine 复旦大学 2020-08-28 CN disclosed
US-4710468-A FROM OPTICALLY ACTIVE SUBSTITUTED HYDROXYBUTYRIC ACID DERIVATIVES WITH OXIDOREDUCTASE SIGMA-TAU INDUSTRIE PHARMACEUTICHE RIUNITE S.P.A. (IT) 1987-12-01 US disclosed