SCHEMBL23881973

SCHEMBL23881973

O=C(CCC(NC(=O)OCc1ccccc1)P(=O)(O)CC1CCCC1)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ECE1 P42892 9/20 0.46
▸ MME P08473 7/20 0.46
▸ ACE2 Q9BYF1 1/20 0.45
▸ CTSL P07711 1/20 0.44
▸ CTSB P07858 1/20 0.44
▸ CTSS P25774 1/20 0.44
▸ CTSK P43235 1/20 0.44
▸ CASP1 P29466 2/20 0.43
▸ BCHE P06276 2/20 0.43
▸ ACHE P22303 2/20 0.43
▸ CCKBR P32239 1/20 0.43
▸ CACNA1F O60840 1/20 0.43
▸ CACNA1D Q01668 1/20 0.43
▸ CACNA1S Q13698 1/20 0.43
▸ CACNA1C Q13936 1/20 0.43

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
SCHEMBL23881976 0.92 ECE1 (0.53) ECE1MMEACE2CTSLCTSB
SCHEMBL23881984 0.89 CASP1 (0.47) ECE1MMEACE2CTSLCTSB
SCHEMBL23881665 0.81 ECE1 (0.50) ECE1MMEACE2CASP1
SCHEMBL23881969 0.79 ACE2 (0.55) ECE1MMEACE2
SCHEMBL23881801 0.77 ACE2 (0.48) ECE1MMEACE2
SCHEMBL10717446 0.77 CTSB (0.52) ECE1MMEACE2CTSLCTSB
SCHEMBL23881979 0.77 ACE2 (0.53) ECE1MMEACE2
SCHEMBL10717382 0.77 CTSL (0.52) ECE1MMEACE2CTSLCTSB
SCHEMBL23881872 0.77 MGLL (0.51) ECE1MMEACE2CASP1
SCHEMBL23881985 0.77 ACE2 (0.53) ECE1MMEACE2

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-20210309677-A1 NOVEL AMINOPHOSPHINIC DERIVATIVES AS AMINOPEPTIDASE A INHIBITORS COLLEGE DE FRANCE (FR) 2021-10-07 — — 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-20210309677-A1 NOVEL AMINOPHOSPHINIC DERIVATIVES AS AMINOPEPTIDASE A INHIBITORS ANPEP, DNPEP, ENPEP ECE1 67/4885MME 24/4885ACE2 179/4885

“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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