SCHEMBL1149415

SCHEMBL1149415

CC(F)OCC[N+](C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 2/20 0.42
SCN2A Q99250 2/20 0.42
SCN3A Q9NY46 2/20 0.42
CHRM5 P08912 6/20 0.36
CHRM1 P11229 6/20 0.36
CHRM3 P20309 6/20 0.36
CHRM2 P08172 5/20 0.36
CHRM4 P08173 5/20 0.36
CHRNB2 P17787 4/20 0.36
CHRNA4 P43681 4/20 0.36
CHRNA7 P36544 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTR1A P08908 2/20 0.36
ADRA2A P08913 1/20 0.36
ADRA1A P35348 1/20 0.36
PGR P06401 1/20 0.36
TBXA2R P21731 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA10 Q9GZZ6 1/20 0.36

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
SCHEMBL21352710 0.81 SCN1A (0.43) SCN1ASCN2ASCN3ACHRM5CHRM1
SCHEMBL12096236 0.80 SCN1A (0.39) SCN1ASCN2ASCN3ACHRM5CHRM1
SCHEMBL5944501 0.78 SCN1A (0.45) SCN1ASCN2ASCN3ACHRM5CHRM1
Hydrochloric Acid SCHEMBL22409396 0.76 SCN1A (0.43) SCN1ASCN2ASCN3ACHRM5CHRM1
Hydrochloric Acid SCHEMBL28431629 0.76 SCN1A (0.43) SCN1ASCN2ASCN3ACHRM5CHRM1
SCHEMBL5056258 0.75 SCN1A (0.39) SCN1ASCN2ASCN3ACHRM5CHRM1
SCHEMBL3696758 0.74 SCN1A (0.42) SCN1ASCN2ASCN3ACHRM5CHRM1
SCHEMBL28761585 0.74 SCN1A (0.42) SCN1ASCN2ASCN3ACHRM5CHRM1
SCHEMBL3686620 0.74 SCN1A (0.42) SCN1ASCN2ASCN3ACHRM5CHRM1
Fluoromethane SCHEMBL27938158 0.73 SCN1A (0.38) SCN1ASCN2ASCN3ACHRM5CHRM1

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
EP-3218333-B1 FLUORIDE TRAPPING ARRANGEMENT GE HEALTHCARE LTD (GB) 2023-06-07 EP claimed
US-20150367005-A1 METHOD OF SYNTHESIZING FLUORINE-18 LABELED RADIOPHARMACEUTICALS IN ETHANOL AND WATER THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2015-12-24 US claimed
US-20080171863-A1 Method for Preparing of Organofluoro Compounds in Alcohol Solvents FUTURECHEM CO., LTD. (KR) 2008-07-17 US claimed
WO-2006082108-A2 IMAGING METHOD AND COMPOSITION FOR IMAGING VASCULAR DISEASES SCHERING AG (DE) 2006-08-10 WO claimed
CN-118108800-A Double-target probe of PSMA and GPC3, preparation method and application 华中科技大学同济医学院附属同济医院 2024-05-31 CN disclosed
EP-3641772-B1 TREATMENT OF HEPATOCELLULAR CARCINOMA CHARACTERIZED BY HEPATITIS B VIRUS INFECTION CELGENE CORP (US) 2023-08-02 EP disclosed
CN-115692668-A Carbon-coated positive electrode material and preparation method and application thereof 格林美(无锡)能源材料有限公司 2023-02-03 CN disclosed
US-20220175770-A1 TREATMENT OF HEPATOCELLULAR CARCINOMA CHARACTERIZED BY HEPATITIS B VIRUS INFECTION CELGENE CORP (US) 2022-06-09 US disclosed
CN-108699087-B 18/19F labeled compounds targeting prostate specific membrane antigen 不列颠哥伦比亚癌症局分支机构 2022-05-17 CN disclosed
EP-3765097-A1 2-ALKOXY-6-[18F]FLUORONICOTINOYL SUBSTITUTED LYS-C(O)-GLU DERIVATIVES AS EFFICIENT PROBES FOR IMAGING OF PSMA EXPRESSING TISSUES Universität zu Köln (DE) 2021-01-20 EP disclosed
US-10639608-B2 System, device and method for preparing tracers and transferring materials during radiosynthesis SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2020-05-05 US disclosed
EP-3641772-A1 TREATMENT OF HEPATOCELLULAR CARCINOMA CHARACTERIZED BY HEPATITIS B VIRUS INFECTION Celgene Corporation (US) 2020-04-29 EP disclosed
US-20080294289-A1 Preparation and Use of Alkylating Agents THE QUEEN'S MEDICAL CENTER (US) 2008-11-27 US disclosed
US-20080171863-A1 Method for Preparing of Organofluoro Compounds in Alcohol Solvents FUTURECHEM CO., LTD. (KR) 2008-07-17 US disclosed
EP-1667794-A2 SYSTEM AND METHOD FOR SYNTHESIS OF MOLECULAR IMAGING PROBES INCLUDING FDG Molecular Technologies Inc. (US) 2006-06-14 EP disclosed
EP-1660433-A2 PREPARATION AND USE OF ALKYLATING AGENTS The Queen's Medical Center (US) 2006-05-31 EP disclosed
US-20050123475-A1 Preparation and use of alkylating agents THE QUEEN'S MEDICAL CENTER 2005-06-09 US disclosed
WO-2005009928-A2 PREPARATION AND USE OF ALKYLATING AGENTS THE QUEEN'S MEDICAL CENTER (US) 2005-02-03 WO disclosed
US-20040258615-A1 System and method for synthesis of molecular imaging probes including FDG MOLECULAR TECHNOLOGIES, INC. 2004-12-23 US disclosed
WO-2004093652-A2 SYSTEM AND METHOD FOR SYNTHESIS OF MOLECULAR IMAGING PROBES INCLUDING FDG MOLECULAR TECHNOLOGIES, INC. (US) 2004-11-04 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 (5 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-20080171863-A1 Method for Preparing of Organofluoro Compounds in Alcohol Solvents ADH5, ADH1C, ADH1A SCN1A 1668/4885SCN2A 2667/4885SCN3A 1433/4885
US-20050123475-A1 Preparation and use of alkylating agents MGMT, MCL1, TOP2A SCN1A 2479/4885SCN2A 2343/4885SCN3A 2214/4885
US-20220175770-A1 TREATMENT OF HEPATOCELLULAR CARCINOMA CHARACTERIZED BY HEPATITIS B VIRUS INFECTION HAVCR2, HCCS, SLC10A1 SCN1A 2616/4885SCN2A 3380/4885SCN3A 3060/4885
US-20150367005-A1 METHOD OF SYNTHESIZING FLUORINE-18 LABELED RADIOPHARMACEUTICALS IN ETHANOL AND WATER TMEM14C, ADH1A, SELENOI SCN1A 2187/4885SCN2A 2106/4885SCN3A 1519/4885
US-10639608-B2 System, device and method for preparing tracers and transferring materials during radiosynthesis TERT, VHL, REV1 SCN1A 4076/4885SCN2A 3926/4885SCN3A 4289/4885

“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.