SCHEMBL4929028

SCHEMBL4929028

COC(=O)C(Cc1ccc(OCc2ccccc2-c2ccccc2)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.61
BCL2 P10415 1/20 0.56
FFAR1 O14842 5/20 0.54
FFAR4 Q5NUL3 5/20 0.54
KLK5 Q9Y337 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
YAP1 P46937 1/20 0.51
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51
CTSS P25774 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
CTSK P43235 1/20 0.50
PPARG P37231 1/20 0.49
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL4929014 1.00 PTPN1 (0.61) PTPN1BCL2FFAR1FFAR4KLK5
SCHEMBL3500186 0.87 BCL2 (0.64) PTPN1BCL2KLK5HDAC8YAP1
SCHEMBL6161729 0.87 BCL2 (0.64) PTPN1BCL2KLK5HDAC8YAP1
SCHEMBL3350988 0.87 BCL2 (0.64) PTPN1BCL2KLK5HDAC8YAP1
SCHEMBL3500428 0.87 PTPN1 (0.70) PTPN1BCL2KLK5HDAC8YAP1
SCHEMBL3497352 0.87 PTPN1 (0.70) PTPN1BCL2KLK5HDAC8YAP1
SCHEMBL4934829 0.84 PTPN1 (0.56) PTPN1BCL2FFAR1FFAR4HDAC8
SCHEMBL4934824 0.84 PTPN1 (0.56) PTPN1BCL2FFAR1FFAR4HDAC8
SCHEMBL10033679 0.83 CTSS (0.69) PTPN1BCL2KLK5CTSSALDH1A1
SCHEMBL1826757 0.83 CTSS (0.69) PTPN1BCL2KLK5CTSSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative KUREHA CORPORATION (JP) 2008-06-05 US disclosed
EP-1707560-A1 HYDROXAMIC ACID DERIVATIVE AND AGE GENERATION INHIBITOR CONTAINING THE DERIVATIVE Kureha Corporation (JP) 2006-10-04 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-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative HDAC5, HDAC1, HDAC9 PTPN1 3437/4885BCL2 3483/4885FFAR1 3533/4885

“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.