SCHEMBL4959935

SCHEMBL4959935

CCCCCS(=O)(=O)N1CCC[C@H]1C(=O)[O-].CCCCCS(=O)(=O)N1CCC[C@H]1C(=O)[O-].[Rh+2]

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 6/20 0.52
MMP8 P22894 5/20 0.40
MMP3 P08254 1/20 0.40
MMP12 P39900 3/20 0.39
MMP13 P45452 3/20 0.39
MMP1 P03956 1/20 0.39
MMP7 P09237 1/20 0.39
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL4959930 1.00 FKBP1A (0.52) FKBP1AMMP8MMP3MMP12MMP13
SCHEMBL3256303 0.86 FKBP1A (0.56) FKBP1AMMP8MMP3MMP12MMP13
SCHEMBL3256301 0.86 FKBP1A (0.56) FKBP1AMMP8MMP3MMP12MMP13
SCHEMBL6830973 0.85 FKBP1A (0.58) FKBP1AMMP8MMP3MMP12MMP13
SCHEMBL6830972 0.85 FKBP1A (0.58) FKBP1AMMP8MMP3MMP12MMP13
SCHEMBL26212073 0.81 FKBP1A (0.51) FKBP1AMMP8MMP12MMP13MMP1
SCHEMBL6831374 0.81 FKBP1A (0.54) FKBP1AMMP8MMP3MMP12MMP13
SCHEMBL6831371 0.81 FKBP1A (0.54) FKBP1AMMP8MMP3MMP12MMP13
Hydroxyamine SCHEMBL5894442 0.79 FKBP1A (0.50) FKBP1AMMP8MMP3MMP12MMP13
SCHEMBL10815653 0.78 FKBP1A (0.48) FKBP1AMMP8MMP3MMP12MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7385064-B1 Catalysts for use in enantioselective synthesis THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2008-06-10 US disclosed
US-7030051-B2 Dirhodium catalyst compositions and methods for using same THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2006-04-18 US disclosed
US-6962891-B2 Solid support dirhodium catalyst compositions and methods for making and using same THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2005-11-08 US disclosed
US-20030130112-A1 Solid support dirhodium catalyst compositions and methods for making and using same RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK, THE 2003-07-10 US disclosed
US-20030130536-A1 Dirhodium catalyst compositions and methods for using same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-07-10 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 (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-20030130112-A1 Solid support dirhodium catalyst compositions and methods for making and using same DOHH, DHODH, HDHD5 FKBP1A 1837/4885MMP8 3332/4885MMP3 4249/4885
US-20030130536-A1 Dirhodium catalyst compositions and methods for using same DOHH, DNPH1, NOTUM FKBP1A 2687/4885MMP8 2948/4885MMP3 4049/4885

“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.