SCHEMBL1560002

SCHEMBL1560002

CN1CCc2cccc([N+](=O)[O-])c2C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.48
LMNA P02545 3/20 0.44
S100A4 P26447 2/20 0.44
MAPT P10636 2/20 0.43
RECQL P46063 1/20 0.43
KMT2A Q03164 1/20 0.43
MCL1 Q07820 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
HPGD P15428 1/20 0.41
GSK3B P49841 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
PTPRC P08575 1/20 0.41
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL30559664 1.00 ACHE (0.48) ACHELMNAS100A4MAPTRECQL
Hydrochloric Acid SCHEMBL17686944 0.98 ACHE (0.47) ACHELMNAS100A4MAPTRECQL
SCHEMBL1644167 0.84 PARP1 (0.51) ACHELMNAS100A4MAPTRECQL
SCHEMBL30692356 0.84 PARP1 (0.51) ACHELMNAS100A4MAPTRECQL
SCHEMBL1558103 0.84 ACHE (0.43) ACHELMNAS100A4MAPTRECQL
SCHEMBL31303745 0.82 ACHE (0.48) ACHELMNAS100A4MAPTRECQL
SCHEMBL10229482 0.80 LMNA (0.48) ACHELMNAS100A4MAPTRECQL
SCHEMBL16284295 0.80 HTR2A (0.44) ACHELMNAMAPTKMT2AHTR2A
SCHEMBL12715961 0.76 HTR2A (0.44) KMT2AHTR2AHTR2CHTR2BHPGD
SCHEMBL2945660 0.75 S100A4 (0.41) ACHELMNAS100A4MAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4744661-A2 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2026-05-20 EP disclosed
EP-4298092-B1 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2025-11-26 EP disclosed
US-20240025883-A1 PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-25 US disclosed
US-20240025883-A1 PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-25 US disclosed
EP-4298092-A1 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-01-03 EP disclosed
CN-116829550-A Pyrimidine-2-ylsulfonamide derivatives 豪夫迈·罗氏有限公司 2023-09-29 CN disclosed
WO-2022180136-A1 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-09-01 WO disclosed
CN-108948019-B Focal adhesion kinase inhibitors and uses thereof 广东东阳光药业有限公司 2022-07-08 CN disclosed
CN-102124000-B Pyridine compounds ASTRAZENECA AB 2014-09-17 CN disclosed
EP-2303861-B1 PYRIDINE COMPOUNDS ASTRAZENECA AB (SE) 2014-04-23 EP disclosed
US-8569298-B2 Pyridine compounds ASTRAZENECA AB (SE) 2013-10-29 US disclosed
US-20110166139-A1 PYRIDINE COMPOUNDS ASTRAZENECA AB (SE) 2011-07-07 US disclosed
EP-2303861-A1 PYRIDINE COMPOUNDS AstraZeneca AB (SE) 2011-04-06 EP disclosed
WO-2009153589-A1 PYRIDINE COMPOUNDS ASTRAZENECA AB (SE) 2009-12-23 WO disclosed
US-20090131436-A1 Pyrimidine Derivatives NOVARTIS AG (CH) 2009-05-21 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 (3 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-20240025883-A1 PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES GPR17, GPR27, GPR119 ACHE 4868/4885LMNA 3569/4885S100A4 2116/4885
US-20110166139-A1 PYRIDINE COMPOUNDS PTK2, PTK2B, PFKP ACHE 2557/4885LMNA 2421/4885S100A4 802/4885
US-20090131436-A1 Pyrimidine Derivatives DPYD, TYMP, TYMS ACHE 3848/4885LMNA 4042/4885S100A4 3962/4885

“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.