Theracys

Theracys

SCHEMBL328885

CN1C2CCC1C(C(=O)O)C(OC(=O)c1ccccc1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.80
SLC6A2 P23975 2/20 0.80
SLC6A4 P31645 2/20 0.80
SLC6A3 Q01959 2/20 0.80
MAPT P10636 1/20 0.80
MAOA P21397 1/20 0.80
SCN1A P35498 1/20 0.80
SCN2A Q99250 1/20 0.80
SIGMAR1 Q99720 1/20 0.80
SCN3A Q9NY46 1/20 0.80

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
Theracys SCHEMBL18648964 1.00 KCNH2 (0.80) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL367470 1.00 KCNH2 (0.80) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL328884 1.00 KCNH2 (0.80) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL116803 1.00 KCNH2 (0.80) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL13196454 1.00 KCNH2 (0.80) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL16922152 1.00 KCNH2 (0.80) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL11415956 0.99 KCNH2 (0.78) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL6716416 0.99 SLC6A2 (0.80) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Theracys SCHEMBL8958743 0.94 KCNH2 (0.72) KCNH2SLC6A2SLC6A4SLC6A3MAPT
Cocaine SCHEMBL8050369 0.93 KCNH2 (0.93) KCNH2SLC6A2SLC6A4SLC6A3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023121486-A1 COMPOSITIONS AND COMPOUNDS FOR TREATING COVID-19 INTERNATIONAL PATENT HOLDINGS LLC (KN) 2023-06-29 WO claimed
EP-3891505-B1 A METHOD FOR MEASURING A CONCENTRATION OF A BIOMARKER/ANALYTE IN BLOOD FROM MAMMALS REDHOTDIAGNOSTICS AB (SE) 2022-11-30 EP claimed
US-8067401-B2 Compounds and compositions for treating infection INTERNATIONAL PATENT HOLDINGS LLC (KN) 2011-11-29 US claimed
US-20090069277-A1 Compounds and compositions for treating infection INTERNATIONAL PATENT HOLDINGS LTD. 2009-03-12 US claimed
EP-4747639-A2 BETA-GALACTOSIDASE ENZYME-BASED IMMUNOASSAY Abbott Diagnostics Scarborough, Inc. (US) 2026-05-27 EP disclosed
EP-4623304-A1 DERIVATISATION AGENT FOR LASER DESORPTION IONIZATION MASS SPECTROMETRY F. Hoffmann-La Roche AG (CH) 2025-10-01 EP disclosed
EP-4623289-A1 METHOD FOR DETERMINING AT LEAST ONE ANALYTE OF INTEREST F. Hoffmann-La Roche AG (CH) 2025-10-01 EP disclosed
WO-2025018987-A2 ΒETA-GALACTOSIDASE ENZYME-BASED IMMUNOASSAY ABBOTT DIAGNOSTICS SCARBOROUGH, INC. (US) 2025-01-23 WO disclosed
WO-2024110385-A1 DERIVATISATION AGENT FOR LASER DESORPTION IONIZATION MASS SPECTROMETRY F. HOFFMANN-LA ROCHE AG (CH) 2024-05-30 WO disclosed
WO-2024110422-A1 METHOD FOR DETERMINING AT LEAST ONE ANALYTE OF INTEREST F. HOFFMANN-LA ROCHE AG (CH) 2024-05-30 WO disclosed
EP-4154010-A1 REAGENT FOR MASS SPECTROMETRY F. Hoffmann-La Roche AG (CH) 2023-03-29 EP disclosed
US-8697660-B2 Compounds and compositions for treating infection INTERNATIONAL PATENT HOLDINGS LLC 2014-04-15 US disclosed
US-6350758-B1 NOVEL ANALOGS OF COCAINE, ENHANCED ANALGESIC AND/OR VASOCONSTRICTIVE PROPERTIES, INHIBIT THE UPTAKE OF DOPAMINE OR SEROTONIN SO USEFUL FOR TREATING PARKINSON'S DISEASE, DEPRESSION, OR OBESITY, TREATING COCAINE ABUSE, COCAINE GEORGETOWN UNIVERSITY 2002-02-26 US disclosed
US-6054127-A A THERAPEUTIC TREATMENT FOR COCAINE ADDICTION; THE CONJUGATE CAPABLE OF STIMULATING THE PRODUCTION OF ANTI-HAPTEN ANTIBODIES; A THERAPEUTIC IMMUNIZATION REGIMEN ELICITS ANTI-DRUG ANTIBODIES IMMULOGIC PHARMACEUTICAL CORPORATION (US) 2000-04-25 US disclosed
EP-0944626-A1 TROPANE DERIVATIVES AND METHOD FOR THEIR SYNTHESIS GEORGETOWN UNIVERSITY (US) 1999-09-29 EP disclosed
WO-1998024788-A1 TROPANE DERIVATIVES AND METHOD FOR THEIR SYNTHESIS GEORGETOWN UNIVERSITY (US) 1998-06-11 WO disclosed
US-5391744-A Enhanced analgesic and vasoconstrictive properties MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 1995-02-21 US disclosed
US-4197237-A Antibodies to nitrogen derivatives of benzoyl ecgonine antigenic conjugates thereof SYVA COMPANY (US) 1980-04-08 US disclosed
US-4123431-A Non-oxo-carbonyl containing benzoyl ecgonine and cocaine compounds and derivatives thereof SYVA COMPANY (US) 1978-10-31 US disclosed
US-4045420-A Non-oxo-carbonyl containing benzoyl ecgonine and cocaine compounds polypeptide and derivatives thereof SYVA COMPANY (US) 1977-08-30 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 (1 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-20090069277-A1 Compounds and compositions for treating infection RPN2, LSS, CLIC4 KCNH2 984/4885SLC6A2 2461/4885SLC6A4 2632/4885

“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.