SCHEMBL31722947

SCHEMBL31722947

CS(=O)(=O)OCCC1(S(C)(=O)=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.46
TSHR P16473 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MMP9 P14780 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL8212255 0.87 KDM4E (0.39) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL21798323 0.77 KDM4E (0.39) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL25520674 0.76 USP2 (0.48) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL373746 0.74 USP2 (0.46) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL15605706 0.74 USP2 (0.46) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL16028605 0.71 KDM4E (0.43) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL6485137 0.71 KDM4E (0.43) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL21798362 0.70 HTR5A (0.30)
SCHEMBL21798392 0.70 TRPA1 (0.32)
SCHEMBL21798084 0.70 KDM4E (0.36) USP2TSHRKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12466821-B2 Antiviral pyridopyrazinedione compounds NOVARTIS AG (CH) 2025-11-11 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-12466821-B2 Antiviral pyridopyrazinedione compounds ZC3HAV1, IL5, TYMP USP2 4211/4885TSHR 4291/4885KDM4E 508/4885

“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.