SCHEMBL13612445

SCHEMBL13612445

CC(C)C(NS(=O)(=O)[Cr])C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
MMP2 P08253 12/20 0.46
MMP9 P14780 11/20 0.46
MMP3 P08254 10/20 0.46
MMP13 P45452 10/20 0.46
MMP1 P03956 9/20 0.46
MMP7 P09237 9/20 0.46
ADAMTS4 O75173 4/20 0.46
MMP14 P50281 1/20 0.44
CA12 O43570 1/20 0.42
CA14 Q9ULX7 1/20 0.42
MMP8 P22894 1/20 0.41

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
SCHEMBL29612792 0.84 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL5839741 0.79 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL5839738 0.79 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL9115909 0.77 KDM4E (0.47) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL7477404 0.77 MMP2 (0.47) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL7477399 0.77 MMP2 (0.47) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL13612447 0.76 ADAMTS4 (0.43) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL9188981 0.76 CA12 (0.50) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL9188977 0.76 CA12 (0.50) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL6341063 0.76 KDM4E (0.46) KDM4EMMP2MMP9MMP3MMP13

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-20090292129-A1 PROCESS FOR RESOLVING RACEMIC MIXTURES AND A DIASTEREOISOMERIC COMPLEX OF A RESOLVING AGENT AND AN ENANTIOMER OF INTEREST ABIOGEN PHARMA S.P.A. (IT) 2009-11-26 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-20090292129-A1 PROCESS FOR RESOLVING RACEMIC MIXTURES AND A DIASTEREOISOMERIC COMPLEX OF A RESOLVING AGENT AND AN ENANTIOMER OF INTEREST SRR, EPHX2, ALOX5 KDM4E 4509/4885MMP2 3701/4885MMP9 2987/4885

“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.