SCHEMBL25759344

SCHEMBL25759344

C=CC[C@H]1[C@@H](O)CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.54
F2 P00734 3/20 0.54
CTSG P08311 2/20 0.54
PREP P48147 3/20 0.49
KLK7 P49862 1/20 0.48
KLK5 Q9Y337 1/20 0.48
ACE2 Q9BYF1 2/20 0.47
HSD17B10 Q99714 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
SCHEMBL31460272 0.88 ELANE (0.54) ELANEF2CTSGPREPKLK7
SCHEMBL1875019 0.87 PREP (0.54) PREPKLK7KLK5ACE2HSD17B10
SCHEMBL30745190 0.82 PREP (0.52) PREPKLK7KLK5ACE2HSD17B10
SCHEMBL25759230 0.82 PREP (0.52) PREPKLK7KLK5ACE2HSD17B10
SCHEMBL25286331 0.82 PREP (0.52) PREPKLK7KLK5ACE2HSD17B10
SCHEMBL24667753 0.82 PREP (0.54) ELANEF2CTSGPREPACE2
SCHEMBL28826460 0.82 PREP (0.54) ELANEF2CTSGPREPACE2
SCHEMBL10310516 0.81 PREP (0.49) PREPKLK7KLK5ACE2HSD17B10
SCHEMBL27766855 0.81 PREP (0.56) PREPKLK7KLK5ACE2HSD17B10
SCHEMBL30745850 0.80 TMEM97 (0.48) PREPKLK7KLK5ACE2HSD17B10

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-20230192614-A1 METHOD FOR PREPARATION OF TRANS-N-BENZYLOXYCARBONYL-(3-HYDROXY-2-PIPERIDINYL)-2-PROPANONE AS INTERMEDIATE OF HALOFUGINONE CHENGDA PHARMACEUTICALS CO., LTD. (CN) 2023-06-22 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-20230192614-A1 METHOD FOR PREPARATION OF TRANS-N-BENZYLOXYCARBONYL-(3-HYDROXY-2-PIPERIDINYL)-2-PROPANONE AS INTERMEDIATE OF HALOFUGINONE TALDO1, RPL22, RPS20 ELANE 994/4885F2 1083/4885CTSG 2227/4885

“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.