SCHEMBL4929580

SCHEMBL4929580

O=C1c2ccc(-c3ccsc3)cc2C(=O)C1(O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.55
CA1 P00915 7/20 0.49
CA2 P00918 7/20 0.49
CA7 P43166 7/20 0.49
CA9 Q16790 7/20 0.49
CA4 P22748 3/20 0.47
PDK2 Q15119 1/20 0.47
ERN1 O75460 2/20 0.44
ACMSD Q8TDX5 1/20 0.44
KCNH2 Q12809 1/20 0.43
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
RECQL P46063 1/20 0.42
BACE1 P56817 1/20 0.42
EHMT2 Q96KQ7 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP2A6 P11509 1/20 0.42

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
SCHEMBL13211693 0.84 CA1 (0.65) CA1CA2CA7CA9CA4
SCHEMBL3022202 0.82 CA1 (0.63) CA1CA2CA7CA9CA4
SCHEMBL3026783 0.82 CA1 (0.63) CA1CA2CA7CA9CA4
SCHEMBL3019070 0.81 CA1 (0.53) PTPRCCA1CA2CA7CA9
SCHEMBL3022167 0.80 CA1 (0.61) CA1CA2CA7CA9CA4
SCHEMBL3025357 0.77 CA1 (0.57) CA1CA2CA7CA9CA4
SCHEMBL14027633 0.75 CA1 (0.59) CA1CA2CA7CA9CA4
SCHEMBL4933930 0.72 SLC6A11 (0.54) CA1CA2CA7CA9CA4
SCHEMBL1960575 0.71 PTPRC (1.00) PTPRCPDK2ERN1ACMSDKCNH2
SCHEMBL8214476 0.69 PTPRC (0.54) PTPRCPDK2ERN1ACMSDKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080248583-A1 Quantitative and Qualitative Chelation Measuring Methods and Materials ALBION LABORATORIES, INC. (US) 2008-10-09 US claimed
WO-2006034195-A2 QUANTITATIVE AND QUALITATIVE CHELATION MEASURING METHODS AND MATERIALS ALBION LABORATORIES, INC. (US) 2006-03-30 WO claimed
US-8338028-B2 Electrode active material for power storage device, power storage device, and electronic and transport devices PANASONIC CORPORATION (JP) 2012-12-25 US disclosed
US-8338028-B2 Electrode active material for power storage device, power storage device, and electronic and transport devices PANASONIC CORPORATION (JP) 2012-12-25 US disclosed
EP-2259371-A1 ELECTRODE ACTIVE MATERIAL FOR ELECTRICITY STORAGE DEVICE, ELECTRICITY STORAGE DEVICE, ELECTRONIC DEVICE AND TRANSPORT DEVICE Panasonic Corporation (JP) 2010-12-08 EP disclosed
US-20100196758-A1 ELECTRODE ACTIVE MATERIAL FOR POWER STORAGE DEVICE, POWER STORAGE DEVICE, AND ELCTRONIC AND TRANSPORT DEVICES PANASONIC CORPORATION (JP) 2010-08-05 US disclosed
WO-2009118990-A1 ELECTRODE ACTIVE MATERIAL FOR ELECTRICITY STORAGE DEVICE, ELECTRICITY STORAGE DEVICE, ELECTRONIC DEVICE AND TRANSPORT DEVICE パナソニック株式会社 (JP) 2009-10-01 WO disclosed
US-20080248583-A1 Quantitative and Qualitative Chelation Measuring Methods and Materials ALBION LABORATORIES, INC. (US) 2008-10-09 US disclosed
US-20080248583-A1 Quantitative and Qualitative Chelation Measuring Methods and Materials ALBION LABORATORIES, INC. (US) 2008-10-09 US disclosed
US-20080248583-A1 Quantitative and Qualitative Chelation Measuring Methods and Materials ALBION LABORATORIES, INC. (US) 2008-10-09 US disclosed
WO-2006034195-A2 QUANTITATIVE AND QUALITATIVE CHELATION MEASURING METHODS AND MATERIALS ALBION LABORATORIES, INC. (US) 2006-03-30 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 (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-20100196758-A1 ELECTRODE ACTIVE MATERIAL FOR POWER STORAGE DEVICE, POWER STORAGE DEVICE, AND ELCTRONIC AND TRANSPORT DEVICES CXCR5, CX3CR1, CCR7 PTPRC 2577/4885CA1 1072/4885CA2 1782/4885
US-20080248583-A1 Quantitative and Qualitative Chelation Measuring Methods and Materials AAAS, LIG4, HAMP PTPRC 3720/4885CA1 1739/4885CA2 2737/4885

“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.