SCHEMBL6033512

SCHEMBL6033512

C[N+](C)(C)CCOC(=O)[C@@H](N)CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 8/20 0.52
CHRM3 P20309 8/20 0.52
CHRM2 P08172 7/20 0.52
CHRM4 P08173 7/20 0.52
CHRM5 P08912 6/20 0.52
CHRNB2 P17787 4/20 0.52
CHRNA4 P43681 4/20 0.52
CHRNA7 P36544 3/20 0.52
HTR1A P08908 2/20 0.52
CYP2C19 P33261 2/20 0.52
LMNA P02545 2/20 0.52
TSHR P16473 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.48
ADRA2A P08913 1/20 0.48
ADRA1A P35348 1/20 0.48
PGR P06401 1/20 0.48
TBXA2R P21731 1/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA10 Q9GZZ6 1/20 0.48

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
SCHEMBL14742426 0.87 ADRA2A (0.55) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL8218840 0.82 ADRA2A (0.50) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL30338047 0.82 SLC22A6 (0.38) LMNASMN1; SMN2
SCHEMBL1683105 0.81 CHRM1 (0.55) CHRM1CHRM3CHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL26985533 0.80 CHRM1 (0.35) CHRM1CHRM3CHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL27131488 0.80 CHRM1 (0.35) CHRM1CHRM3CHRM2CHRM4CHRM5
Acetylcholine SCHEMBL17629404 0.80 CHRM1 (0.58) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL6034400 0.79 CHRM1 (0.50) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL2530101 0.79 CHRM1 (0.53) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL1075213 0.79 HCAR2 (0.39) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5124061-A Systemic plant cryoprotection with choline salts GEARY SR ROBERT J (US) 1992-06-23 US claimed
US-12305213-B2 High gravity, fed-batch ionic liquid based process for deconstructing biomass NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2025-05-20 US disclosed
US-20240226045-A9 RUMEN-PROTECTED COMPOSITIONS AND METHODS OF MAKING THE SAME BALCHEM CORPORATION 2024-07-11 US disclosed
WO-2024092005-A2 RUMEN-PROTECTED COMPOSITIONS AND METHODS OF MAKING THE SAME BALCHEM CORPORATION (US) 2024-05-02 WO disclosed
US-20240130991-A1 RUMEN-PROTECTED COMPOSITIONS AND METHODS OF MAKING THE SAME BALCHEM CORP (US) 2024-04-25 US disclosed
CN-116725015-A Application of exogenous choline aspartic acid in improving corn yield 西北农林科技大学 2023-09-12 CN disclosed
US-20220170053-A1 HIGH GRAVITY, FED-BATCH IONIC LIQUID BASED PROCESS FOR DECONSTRUCTING BIOMASS UNITED STATES DEPARTMENT OF ENERGY 2022-06-02 US disclosed
US-11118197-B2 High gravity, fed-batch ionic liquid based process for deconstructing biomass NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2021-09-14 US disclosed
US-20180346938-A1 HIGH GRAVITY, FED-BATCH IONIC LIQUID BASED PROCESS FOR DECONSTRUCTING BIOMASS UNITED STATES DEPARTMENT OF ENERGY 2018-12-06 US disclosed
EP-1660017-A2 AMINO ACID PRODRUGS Signature R&D Holdings, LLC (US) 2006-05-31 EP disclosed
WO-2005046575-A2 AMINO ACID PRODRUGS SIGNATURE R & D HOLDINGS, LCC (US) 2005-05-26 WO disclosed