SCHEMBL6290849

SCHEMBL6290849

CC(C)(C)OC(=O)N[C@@H](CCNC(=O)OCc1ccccc1)C(=O)Nc1ccc(C(c2ccc(NC(=O)[C@H](CCNC(=O)OCc3ccccc3)NC(=O)OC(C)(C)C)cc2)c2ccc(NC(=O)[C@H](CCNC(=O)OCc3ccccc3)NC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
SIRT2 Q8IXJ6 9/20 0.51
SIRT1 Q96EB6 8/20 0.51
SIRT3 Q9NTG7 3/20 0.51
SIRT5 Q9NXA8 3/20 0.51
KLK7 P49862 2/20 0.50
KLK5 Q9Y337 2/20 0.50
CTSS P25774 2/20 0.49
CTSK P43235 1/20 0.49
SYK P43405 1/20 0.48

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
SCHEMBL7763637 0.87 MAPT (0.57) MAPTKLK7KLK5CTSSCTSK
SCHEMBL7763641 0.87 MAPT (0.57) MAPTKLK7KLK5CTSSCTSK
SCHEMBL8246035 0.86 CTSS (0.56) SIRT2SIRT1SIRT3SIRT5CTSS
SCHEMBL5301318 0.86 CTSS (0.56) SIRT2SIRT1SIRT3SIRT5CTSS
SCHEMBL4602404 0.83 MAPT (0.60) MAPTKLK7KLK5CTSSCTSK
SCHEMBL1024713 0.83 MAPT (0.60) MAPTKLK7KLK5CTSSCTSK
SCHEMBL30962415 0.83 MAPT (0.60) MAPTKLK7KLK5CTSSCTSK
SCHEMBL6621271 0.83 MAPT (0.60) MAPTKLK7KLK5CTSSCTSK
SCHEMBL5308048 0.82 SIRT5 (0.59) SIRT2SIRT1SIRT3SIRT5SYK
SCHEMBL8244805 0.82 SIRT5 (0.59) SIRT2SIRT1SIRT3SIRT5SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK MAPT 4866/4885SIRT2 1857/4885SIRT1 1402/4885

“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.