SCHEMBL4170969

SCHEMBL4170969

CS(=O)(=O)c1ccc(C2CCNCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.52
SIGMAR1 Q99720 1/20 0.52
HTR2C P28335 5/20 0.49
PLAT P00750 1/20 0.45
PTGS2 P35354 1/20 0.45
QDPR P09417 1/20 0.44
HTR6 P50406 3/20 0.43
HTR3A P46098 1/20 0.42
JAK3 P52333 1/20 0.42
PTK2 Q05397 1/20 0.42
LIMK2 P53671 1/20 0.41
DRD3 P35462 1/20 0.41
ENPP2 Q13822 1/20 0.41

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 SCHEMBL17514308 0.98 HTR2C (0.50) SLC18A3SIGMAR1HTR2CPLATPTGS2
SCHEMBL13176976 0.86 PTGS2 (0.51) PTGS2ENPP2
SCHEMBL469038 0.82 LMNA (0.56) PTGS2ENPP2
SCHEMBL12473626 0.82 LMNA (0.51) PTGS2ENPP2
SCHEMBL22324769 0.82 SLC18A3 (0.48) SLC18A3SIGMAR1HTR2CQDPRHTR6
SCHEMBL9827832 0.81 SLC18A3 (0.52) SLC18A3SIGMAR1HTR2CQDPRHTR6
SCHEMBL5694991 0.81 SLC18A3 (0.52) SLC18A3SIGMAR1HTR2CQDPRHTR6
SCHEMBL26354332 0.81 LMNA (0.59) PTGS2
SCHEMBL10182153 0.81 LMNA (0.59) PTGS2
SCHEMBL17117325 0.81 HTR2C (0.50) SLC18A3SIGMAR1HTR2CQDPRHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023062049-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-04-20 WO disclosed
WO-2022125925-A1 COMPOSITIONS FOR TREATING DRY AGE-RELATED MACULAR DEGENERATION (AMD) COGNITION THERAPEUTICS, INC. (US) 2022-06-16 WO disclosed
WO-2016027284-A2 PIPERIDINE UREAS AS CATHEPSIN CYSTEINE PROTEASE INHIBITORS ALKEM LABORATORIES LTD. (IN) 2016-02-25 WO disclosed
US-20090203676-A1 G-protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2009-08-13 US disclosed
US-20090105305-A1 Therapeutic Agents - 550 ASTRAZENECA AB (SE) 2009-04-23 US disclosed
CN-101252929-A G protein-coupled receptor agonists PROSIDION LTD (GB) 2008-08-27 CN disclosed
WO-2008075070-A1 SULFONAMIDE DERIVATIVES FOR THERAPEUTIC USE AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-06-26 WO disclosed
WO-2008059214-A1 BISAMLDE DERIVATIVES AND USE THEREOF AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-05-22 WO disclosed
EP-1909791-A1 G-PROTEIN COUPLED RECEPTOR AGONISTS Prosidion Limited (GB) 2008-04-16 EP disclosed
WO-2007003964-A1 G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2007-01-11 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-20090105305-A1 Therapeutic Agents - 550 FABP4, GPR119, FASN SLC18A3 4645/4885SIGMAR1 4037/4885HTR2C 4806/4885
US-20090203676-A1 G-protein Coupled Receptor Agonists GPR119, GCGR, GPBAR1 SLC18A3 1217/4885SIGMAR1 487/4885HTR2C 440/4885

“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.