SCHEMBL17447104

SCHEMBL17447104

CCC1OC(OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc2ccccc2)C(NC(C)=O)C(C)C1C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KLK7 P49862 7/20 0.45
▸ KLK5 Q9Y337 7/20 0.45
▸ PPARA Q07869 2/20 0.43
▸ SYK P43405 1/20 0.43
▸ CTSS P25774 2/20 0.41
▸ PPARG P37231 1/20 0.40
▸ PTPN1 P18031 4/20 0.40
▸ CDC25B P30305 4/20 0.40
▸ PTPN2 P17706 3/20 0.40
▸ CDC25A P30304 2/20 0.40
▸ PTPN6 P29350 1/20 0.39
▸ PTPN11 Q06124 1/20 0.39
▸ CTSK P43235 1/20 0.38
▸ CACNA1B Q00975 2/20 0.38

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
SCHEMBL19903806 0.82 LMNA (0.59) KLK7KLK5PPARAPTPN1CDC25B
SCHEMBL16158925 0.81 KLK7 (0.51) KLK7KLK5PPARASYKCTSS
SCHEMBL16158881 0.81 KLK7 (0.51) KLK7KLK5PPARASYKCTSS
SCHEMBL10333714 0.74 TP53 (0.46) CTSSPTPN1CDC25BPTPN2CDC25A
SCHEMBL16144925 0.73 PTPN1 (0.56) KLK7KLK5PPARASYKCTSS
SCHEMBL16144930 0.73 PTPN1 (0.56) KLK7KLK5PPARASYKCTSS
SCHEMBL15569246 0.73 PPARA (0.60) KLK7KLK5PPARASYKCTSS
SCHEMBL8138595 0.73 PPARA (0.60) KLK7KLK5PPARASYKCTSS
SCHEMBL7518373 0.73 PPARA (0.74) KLK7KLK5PPARASYKCTSS
SCHEMBL31372427 0.73 PPARA (0.60) KLK7KLK5PPARASYKCTSS

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-20160017015-A1 GLYCO-MODIFIED ATRIAL NATRIURETIC PEPTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-01-21 — — 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-20160017015-A1 GLYCO-MODIFIED ATRIAL NATRIURETIC PEPTIDE NPPA, NPR1, NPR3 KLK7 1552/4885KLK5 1459/4885PPARA 3835/4885

“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.

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