SCHEMBL25759230

SCHEMBL25759230

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

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PREP P48147 3/20 0.52
ACE2 Q9BYF1 3/20 0.51
NPSR1 Q6W5P4 1/20 0.49
TSHR P16473 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KLK7 P49862 1/20 0.48
KLK5 Q9Y337 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
CTSK P43235 1/20 0.48
GFER P55789 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CTRB1 P17538 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
SCHEMBL30745190 1.00 PREP (0.52) PREPACE2NPSR1TSHRL3MBTL1
SCHEMBL25286331 1.00 PREP (0.52) PREPACE2NPSR1TSHRL3MBTL1
SCHEMBL1875019 0.88 PREP (0.54) PREPACE2NPSR1TSHRL3MBTL1
SCHEMBL10310516 0.87 PREP (0.49) PREPACE2NPSR1TSHRL3MBTL1
SCHEMBL3011829 0.83 PREP (0.56) PREPACE2NPSR1TSHRL3MBTL1
SCHEMBL30415573 0.83 SMN1; SMN2 (0.51) PREPNPSR1
SCHEMBL10310512 0.83 PREP (0.56) PREPACE2NPSR1TSHRL3MBTL1
SCHEMBL25248996 0.83 SMN1; SMN2 (0.51) PREPNPSR1
SCHEMBL25759344 0.82 ELANE (0.54) PREPACE2KLK7KLK5HSD17B10
SCHEMBL27766855 0.82 PREP (0.56) PREPACE2NPSR1TSHRL3MBTL1

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 PREP 1233/4885ACE2 2855/4885NPSR1 1320/4885

“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.