SCHEMBL2804607

SCHEMBL2804607

C[N+](C)(C)CCOCC(N)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.56
CHRM3 P20309 7/20 0.56
CHRM5 P08912 6/20 0.56
CHRM2 P08172 6/20 0.56
CHRM4 P08173 6/20 0.56
CHRNB2 P17787 4/20 0.56
CHRNA4 P43681 4/20 0.56
CHRNA7 P36544 3/20 0.56
HTR1A P08908 2/20 0.56
CYP2C19 P33261 2/20 0.56
LMNA P02545 2/20 0.56
TSHR P16473 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.46
ADRA2A P08913 1/20 0.46
ADRA1A P35348 1/20 0.46
PGR P06401 1/20 0.46
TBXA2R P21731 1/20 0.46
CHRNB4 P30926 1/20 0.46
CHRNA3 P32297 1/20 0.46
CHRNA10 Q9GZZ6 1/20 0.46

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
Hydrochloric Acid SCHEMBL1759062 0.98 CHRM5 (0.57) CHRM1CHRM3CHRM5CHRM2CHRM4
Ammonia Solution, Strong SCHEMBL28330597 0.98 CHRM1 (0.54) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL808458 0.80 CHRM1 (0.54) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL3784397 0.79 CHRM1 (0.48) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL7125777 0.79 CHRM1 (0.54) CHRM1CHRM3CHRM5CHRM2CHRM4
Hydrochloric Acid SCHEMBL16637633 0.77 CHRM5 (0.56) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL28421705 0.77 CHRM1 (0.46) CHRM1CHRM3CHRM5CHRM2CHRM4
Hydrochloric Acid SCHEMBL28878493 0.77 CHRM1 (0.50) CHRM1CHRM3CHRM5CHRM2CHRM4
SCHEMBL2010713 0.77 CES2 (0.37) CYP2C19LMNATSHRSMN1; SMN2BLM
SCHEMBL2241590 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250041211-A1 OPHTHALMIC PREPARATION AND APPLICATION THEREOF IN TREATMENT OF PRESBYOPIA Eye Hospital, Wenzhou Medical University (CN) 2025-02-06 US claimed
CN-113164043-A Compositions and methods for glaucoma 奥夫博医疗创新有限公司 2021-07-23 CN claimed
EP-1363877-A2 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE SmithKline Beecham Corporation (US) 2003-11-26 EP claimed
WO-2002070470-A2 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE SMITHKLINE BEECHAM CORPORATION (US) 2002-09-12 WO claimed
EP-3773730-B1 DRUG DELIVERY FORMULATIONS UNIV CALIFORNIA (US) 2026-05-13 EP disclosed
US-20250041211-A1 OPHTHALMIC PREPARATION AND APPLICATION THEREOF IN TREATMENT OF PRESBYOPIA Eye Hospital, Wenzhou Medical University (CN) 2025-02-06 US disclosed
US-20240245623-A1 MODULAR TRANSDERMAL DELIVERY SYSTEM AND ASSOCIATED METHODS OF MANUFACTURE AND USE PURE RATIOS HOLDING INC (US) 2024-07-25 US disclosed
CN-116322332-A Antipathogenic agent, antibacterial agent, antiviral agent, pathogen treatment device, method for producing antipathogenic agent, antibacterial method, virus inactivation method, and pathogen treatment method 株式会社ACENET 2023-06-23 CN disclosed
US-11583217-B2 Neurophysiological data analysis using spatiotemporal parcellation FIREFLY NEUROSCIENCE LTD. (IL) 2023-02-21 US disclosed
CN-115161257-A Improved differentiation process 荷兰皇家科学院 2022-10-11 CN disclosed
CN-113081991-B Pharmaceutical dosage forms and uses thereof 南京三迭纪医药科技有限公司 2022-07-15 CN disclosed
CN-114585365-A Use of parasympathomimetic agents alone or in combination with one or more alpha agonists to produce multifocal patients in pseudolens patients 视觉治疗股份有限公司 2022-06-03 CN disclosed
US-20030133985-A1 Formulation of an erodible, gastric retentive oral dosage form using in vitro disintegration test data ASSERTIO THERAPEUTICS, INC. 2003-07-17 US disclosed
US-20030104052-A1 Gastric retentive oral dosage form with restricted drug release in the lower gastrointestinal tract ASSERTIO THERAPEUTICS, INC. (F/K/A DEPOMED, INC.) 2003-06-05 US disclosed
US-20030091630-A1 Formulation of an erodible, gastric retentive oral dosage form using in vitro disintegration test data ASSERTIO THERAPEUTICS, INC. 2003-05-15 US disclosed
WO-2003035029-A1 FORMULATION OF AN ERODIBLE, GASTRIC RETENTIVE ORAL DOSAGE FORM USING IN VITRO DISINTEGRATION TEST DATA DEPOMED, INC. (US) 2003-05-01 WO disclosed
WO-2003035041-A1 GASTRIC RETENTIVE ORAL DOSAGE FORM WITH RESTRICTED DRUG RELEASE IN THE LOWER GASTROINTESTINAL TRACT DEPOMED, INC. (US) 2003-05-01 WO disclosed
US-20030026850-A1 N,N-dinitramide salts as solubilizing agents for biologically active agents SRI INTERNATIONAL 2003-02-06 US disclosed
WO-2003006371-A1 N,N-DINITRAMIDE SALTS AS SOLUBILIZING AGENTS FOR BIOLOGICALLY ACTIVE AGENTS SRI INTERNATIONAL (US) 2003-01-23 WO disclosed
WO-2002070470-A2 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE SMITHKLINE BEECHAM CORPORATION (US) 2002-09-12 WO 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-20030026850-A1 N,N-dinitramide salts as solubilizing agents for biologically active agents NPPA, NUCB2, DNPEP CHRM1 2477/4885CHRM3 1645/4885CHRM5 1610/4885
US-20030104052-A1 Gastric retentive oral dosage form with restricted drug release in the lower gastrointestinal tract SI, GIPR, MLNR CHRM1 2179/4885CHRM3 2431/4885CHRM5 2960/4885

“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.