SCHEMBL8212255

SCHEMBL8212255

CS(=O)(=O)OCCC1(S(C)(=O)=O)CCNCC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MMP9 P14780 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL31722947 0.87 USP2 (0.46) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL16862274 0.81 KDM4E (0.41) KDM4EUSP2ALDH1A1LMNAMMP9
Busulfan SCHEMBL28144825 0.72 TSHR (0.75) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL18151741 0.71 KDM4E (0.35) KDM4E
Hydrochloric Acid SCHEMBL28895013 0.69 KDM4E (0.34) KDM4E
SCHEMBL25520674 0.69 USP2 (0.48) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL20323423 0.68 KDM4E (0.33) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL15605706 0.67 USP2 (0.46) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL373746 0.67 USP2 (0.46) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL1965412 0.67 KDM4E (0.32) KDM4EUSP2ALDH1A1LMNAMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102482236-B Indenone derivative and pharmaceutical composition comprising same KOREA RES INST CHEM TECH 2015-01-28 CN disclosed
US-8877747-B2 Indenone derivative and pharmaceutical composition comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2014-11-04 US disclosed
EP-2475649-B1 INDENONE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RES INST CHEM TECH (KR) 2014-08-13 EP disclosed
US-20120214991-A1 Indenone Derivative and Pharmaceutical Composition Comprising Same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-08-23 US disclosed
EP-2475649-A1 INDENONE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Korea Research Institute Of Chemical Technology (KR) 2012-07-18 EP disclosed
CN-102482236-A Indanone derivatives and pharmaceutical compositions containing the same KOREA RES INST CHEM TECH 2012-05-30 CN disclosed
WO-2011030955-A1 INDENONE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2011-03-17 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 (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-20120214991-A1 Indenone Derivative and Pharmaceutical Composition Comprising Same INSR, HSD17B7, SOST KDM4E 1070/4885USP2 4545/4885ALDH1A1 1751/4885

“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.