SCHEMBL23675642

SCHEMBL23675642

COCC(C)(C)S(=O)(=O)C1(CNC(=O)OC(C)(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.36
CA12 O43570 8/20 0.35
CA2 P00918 6/20 0.35
CA14 Q9ULX7 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
CA1 P00915 6/20 0.33
CA9 Q16790 5/20 0.33
EPHX1 P07099 1/20 0.33
CA7 P43166 1/20 0.33
DRD2 P14416 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
CACNA1H O95180 1/20 0.31

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
SCHEMBL21798007 0.72 LMNA (0.33)
Hydrochloric Acid SCHEMBL21798240 0.71
SCHEMBL18866772 0.70 HCRTR2 (0.41) HCRTR2CA12CA2CA14TDP1
SCHEMBL15497077 0.69 HCRTR2 (0.43) HCRTR2CA12CA2CA14TDP1
SCHEMBL13641704 0.69 HCRTR2 (0.48) HCRTR2CA12CA2CA14TDP1
SCHEMBL15497076 0.69 HCRTR2 (0.44) HCRTR2CA12CA2TDP1MEN1
SCHEMBL21798133 0.68
SCHEMBL8253836 0.68 HCRTR2 (0.42) HCRTR2CA12CA2TDP1MEN1
SCHEMBL14351298 0.68 TDP1 (0.45) HCRTR2CA12CA2CA14TDP1
SCHEMBL21798404 0.68 CYP3A4 (0.34) MEN1KMT2AGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230052629-A1 ANTIVIRAL PYRIDOPYRAZINEDIONE COMPOUNDS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2023-02-16 US disclosed
US-11072610-B2 Antiviral pyridopyrazinedione compounds NOVARTIS AG (CH) 2021-07-27 US disclosed
CN-112996789-A Antiviral pyridopyrazinedione compounds 诺华股份有限公司 2021-06-18 CN 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-20230052629-A1 ANTIVIRAL PYRIDOPYRAZINEDIONE COMPOUNDS ZC3HAV1, IL5, TYMP HCRTR2 3981/4885CA12 4253/4885CA2 3139/4885
US-11072610-B2 Antiviral pyridopyrazinedione compounds ZC3HAV1, IL5, TYMP HCRTR2 3981/4885CA12 4253/4885CA2 3139/4885

“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.