SCHEMBL5224618

SCHEMBL5224618

CS(=O)(=O)OCC1OC1COS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.42
TSHR P16473 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MMP9 P14780 1/20 0.42
ALOX15 P16050 1/20 0.42
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
HPSE Q9Y251 6/20 0.31
PTPN1 P18031 1/20 0.30
ACP1 P24666 1/20 0.30
CDC25B P30305 1/20 0.30

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
SCHEMBL5224607 1.00 USP2 (0.42) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL8533728 0.88 LMNA (0.37) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL8529865 0.88 LMNA (0.37) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL10703456 0.87 KDM4E (0.33) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL8532800 0.83 KDM4E (0.33) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL8532685 0.83 ALDH1A1 (0.33) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL8529469 0.83 ALDH1A1 (0.33) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL8529027 0.81 KDM4E (0.32) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL9360125 0.80 FGF1 (0.33) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL9364336 0.80 FGF1 (0.33) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1375496-B1 N-ARYL-SUBSTITUTED CYCLIC AMINE DERIVATIVE AND MEDICINE CONTAINING THE SAME AS ACTIVE INGREDIENT EISAI R&D MAN CO LTD (JP) 2007-07-04 EP disclosed
US-7112593-B2 N-aryl-substituted cyclic amine derivative and medicine containing the same as active ingredient EISAI CO., LTD. (JP) 2006-09-26 US disclosed
US-20040072830-A1 N-aryl-substituted cyclic amine derivative and medicine containing the same as active ingredient EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-04-15 US disclosed
EP-1375496-A1 N-ARYL-SUBSTITUTED CYCLIC AMINE DERIVATIVE AND MEDICINE CONTAINING THE SAME AS ACTIVE INGREDIENT Eisai Co., Ltd. (JP) 2004-01-02 EP 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-20040072830-A1 N-aryl-substituted cyclic amine derivative and medicine containing the same as active ingredient COASY, HCCS, SQLE USP2 3445/4885TSHR 3428/4885KDM4E 2089/4885

“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.