SCHEMBL16353041

SCHEMBL16353041

C[N+](C)(C)CCOC(=O)CCCC(=O)OCC[N+](C)(C)C

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.82
ADRA1A P35348 1/20 0.82
MAPT P10636 1/20 0.78
BLM P54132 1/20 0.78
CYP2C19 P33261 2/20 0.61
CHRM5 P08912 6/20 0.60
CHRM1 P11229 6/20 0.60
CHRM3 P20309 6/20 0.60
CHRM2 P08172 5/20 0.60
CHRM4 P08173 5/20 0.60
CHRNB2 P17787 4/20 0.60
CHRNA4 P43681 4/20 0.60
CHRNA7 P36544 3/20 0.60
HTR1A P08908 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
PGR P06401 1/20 0.60
TBXA2R P21731 1/20 0.60
CHRNB4 P30926 1/20 0.60
CHRNA3 P32297 1/20 0.60
CHRNA10 Q9GZZ6 1/20 0.60

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
SCHEMBL16353067 0.95 ADRA2A (0.82) ADRA2AADRA1AMAPTBLMCYP2C19
SCHEMBL8087675 0.93 ADRA2A (0.78) ADRA2AADRA1AMAPTBLMCYP2C19
SCHEMBL1984572 0.93 ADRA2A (0.78) ADRA2AADRA1AMAPTBLMCYP2C19
SCHEMBL28047745 0.92 ADRA2A (0.69) ADRA2AADRA1AMAPTBLMCYP2C19
Iodide SCHEMBL15378186 0.91 ADRA2A (0.75) ADRA2AADRA1AMAPTBLMCYP2C19
Iodide SCHEMBL1980845 0.91 ADRA2A (0.75) ADRA2AADRA1AMAPTBLMCYP2C19
Suxamethonium SCHEMBL41537 0.90 ADRA2A (1.00) ADRA2AADRA1AMAPTBLMCYP2C19
SCHEMBL16352919 0.89 ADRA2A (0.72) ADRA2AADRA1AMAPTBLMCYP2C19
Suxamethonium SCHEMBL2821312 0.88 ADRA2A (0.95) ADRA2AADRA1AMAPTBLMCYP2C19
Suxamethonium SCHEMBL1643328 0.88 ADRA2A (0.95) ADRA2AADRA1AMAPTBLMCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023174433-A1 SOLID, SEMISOLID, OR LIQUID COMPOSITIONS FOR AUGMENTING THE STABILITY, PERMEABILITY AND BIOAVAILABILITY OF ACTIVE PHARMACEUTICAL SUBSTANCES Smart Pharmaceutical (Suzhou) Co., Ltd. (CN) 2023-09-21 WO claimed
CN-116725011-A Promotion of germination of mung bean seeds by exogenous choline glutaric acid 西北农林科技大学 2023-09-12 CN claimed
WO-2023174433-A1 SOLID, SEMISOLID, OR LIQUID COMPOSITIONS FOR AUGMENTING THE STABILITY, PERMEABILITY AND BIOAVAILABILITY OF ACTIVE PHARMACEUTICAL SUBSTANCES Smart Pharmaceutical (Suzhou) Co., Ltd. (CN) 2023-09-21 WO disclosed
CN-116725011-A Promotion of germination of mung bean seeds by exogenous choline glutaric acid 西北农林科技大学 2023-09-12 CN disclosed
CN-116725011-A Promotion of germination of mung bean seeds by exogenous choline glutaric acid 西北农林科技大学 2023-09-12 CN disclosed
US-11720018-B2 Chemically amplified resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-08-08 US disclosed
US-20230152692-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20230152692-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20220257767-A1 IONIC LIQUIDS FOR DRUG DELIVERY PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-08-18 US disclosed
EP-3946261-A1 IONIC LIQUIDS FOR DRUG DELIVERY President And Fellows Of Harvard College (US) 2022-02-09 EP disclosed
CN-113939273-A Ionic liquids for drug delivery 哈佛大学校长及研究员协会 2022-01-14 CN disclosed
US-20220004101-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-01-06 US disclosed
US-20210033969-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-02-04 US disclosed
WO-2020205409-A1 IONIC LIQUIDS FOR DRUG DELIVERY PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2020-10-08 WO disclosed
US-20180143532-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-24 US disclosed
US-20180086948-A1 ADHESIVE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING A BIO-ELECTRODE, AND SALT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-03-29 US disclosed
US-20140377706-A1 DEVELOPER FOR PHOTOSENSITIVE RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220257767-A1 IONIC LIQUIDS FOR DRUG DELIVERY SLCO4C1, SLC47A1, ABCB11 ADRA2A 1699/4885ADRA1A 1627/4885MAPT 170/4885
US-20180086948-A1 ADHESIVE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING A BIO-ELECTRODE, AND SALT SLC9A1, FN1, EPCAM ADRA2A 3217/4885ADRA1A 1359/4885MAPT 3241/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.