SCHEMBL8846196

SCHEMBL8846196

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.36
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CACNA2D1 P54289 2/20 0.34
CACNB3 P54284 1/20 0.34
CACNA1C Q13936 1/20 0.34
PGR P06401 1/20 0.34
ADRA1A P35348 1/20 0.34
HTR2B P41595 1/20 0.34
CACNA2D2 Q9NY47 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
FOLH1 Q04609 1/20 0.33
GABRR1 P24046 2/20 0.31
LMNA P02545 1/20 0.31
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30

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
SCHEMBL27726143 1.00 SLC22A6 (0.36) SLC22A6TSHRTDP1CACNA2D1CACNB3
SCHEMBL27509432 1.00 SLC22A6 (0.36) SLC22A6TSHRTDP1CACNA2D1CACNB3
SCHEMBL692357 0.85 SLC22A6 (0.43) SLC22A6TSHRTDP1CACNA2D1CACNB3
SCHEMBL27857944 0.85 SLC22A6 (0.43) SLC22A6TSHRTDP1CACNA2D1CACNB3
SCHEMBL3896270 0.80 SLC22A6 (0.39) SLC22A6TSHRTDP1CACNA2D1CACNB3
SCHEMBL6575970 0.80
SCHEMBL27260660 0.80
SCHEMBL27654688 0.80
SCHEMBL28247883 0.79 ADRA1A (0.41) SLC22A6TSHRTDP1CACNA2D1CACNB3
SCHEMBL16982392 0.79 ADRA1A (0.41) SLC22A6TSHRTDP1CACNA2D1CACNB3

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117947112-A Preparation method of (R) -4-chloro-3-hydroxy-ethyl butyrate 万华化学集团股份有限公司 2024-04-30 CN claimed
CN-117721088-A Glucose dehydrogenase mutant and use thereof 万华化学集团股份有限公司 2024-03-19 CN claimed
CN-113528588-A Preparation method of levocarnitine 海南卓科制药有限公司 2021-10-22 CN claimed
CN-108018321-A The biological synthesis method of l-carnitine 武汉佰施达生物技术有限公司 2018-05-11 CN claimed
CN-103709058-B A kind of synthetic method of L-carnitine SUZHOU ENZYMEWORKS, INC. (CN) 2015-09-02 CN claimed
CN-102603607-B Preparation method of (R)-oxiracetam CHONGQING RUNZE MEDICAL EQUIPMENT & SUPPLIES CO LTD 2014-06-11 CN claimed
CN-103709058-A Synthetic method for L-carnitine ENZYMEWORKS INC 2014-04-09 CN claimed
CN-101875616-B Levocarnitine compound and new preparation method thereof JIANRONG HU 2012-11-21 CN claimed
CN-102603607-A Preparation method of (R)-oxiracetam CHONGQING RUNZE MEDICAL EQUIPMENT & SUPPLIES CO LTD 2012-07-25 CN claimed
CN-101875616-A Levocarnitine compound and new preparation method thereof JIANRONG HU 2010-11-03 CN claimed
EP-0648201-B1 ENANTIOSELECTIVE HYDROGENATION OF THE CARBONYL BOND USING RUTHENIUM COMPLEXES WITH BIPHOSPHINE LIGANDS ELF AQUITAINE (FR) 1997-01-22 EP claimed
CN-117947112-A Preparation method of (R) -4-chloro-3-hydroxy-ethyl butyrate 万华化学集团股份有限公司 2024-04-30 CN disclosed
CN-117947112-A Preparation method of (R) -4-chloro-3-hydroxy-ethyl butyrate 万华化学集团股份有限公司 2024-04-30 CN disclosed
CN-117947112-A Preparation method of (R) -4-chloro-3-hydroxy-ethyl butyrate 万华化学集团股份有限公司 2024-04-30 CN disclosed
CN-117721088-A Glucose dehydrogenase mutant and use thereof 万华化学集团股份有限公司 2024-03-19 CN disclosed
CN-101273137-A Oxidoreductases for stereoselective reduction of keto compounds IEP GMBH (DE) 2008-09-24 CN disclosed
CN-100348573-C Method for preparing L-carnitine HONGKONG TECH UNIV (HK) 2007-11-14 CN disclosed
CN-1255375-C Industrial process for producing L-carnitine SIGMA TAU IND FARMACEUTI (IT) 2006-05-10 CN disclosed
CN-1727328-A Method for preparing L-carnitine HONGKONG TECH UNIV (HK) 2006-02-01 CN disclosed
CN-1326435-A Industrial process for production of L-carnitine SIGMA TAU IND FARMACEUTI (IT) 2001-12-12 CN disclosed