SCHEMBL6827227

SCHEMBL6827227

COc1ccc(CN[C@H](C(C)C)P(=O)(OCc2ccccc2)OC(CCCCNC(=O)OCc2ccccc2)C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 1/20 0.42
▸ ELANE P08246 2/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ FOLH1 Q04609 3/20 0.42
▸ PSMB5 P28074 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ PRTN3 P24158 1/20 0.41
▸ SLC6A5 Q9Y345 1/20 0.40
▸ DPP8 Q6V1X1 1/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40
▸ CTSL P07711 1/20 0.40
▸ CTSS P25774 1/20 0.40
▸ CTSK P43235 1/20 0.40
▸ ITGB3 P05106 1/20 0.40
▸ ITGAV P06756 1/20 0.40

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
SCHEMBL6827234 1.00 CTSD (0.42) CTSDELANECA1CA2FOLH1
SCHEMBL6824125 0.81 DPP8 (0.51) CA1CA2FOLH1DPP8DPP7
SCHEMBL6824120 0.81 DPP8 (0.51) CA1CA2FOLH1DPP8DPP7
SCHEMBL6827321 0.80 FOLH1 (0.47) ELANECA1CA2FOLH1PRTN3
SCHEMBL6827330 0.80 FOLH1 (0.47) ELANECA1CA2FOLH1PRTN3
SCHEMBL6827235 0.80 FOLH1 (0.46) ELANECA1CA2FOLH1PRTN3
SCHEMBL6827237 0.80 FOLH1 (0.46) ELANECA1CA2FOLH1PRTN3
SCHEMBL6829510 0.77 ELANE (0.42) ELANECA1CA2FOLH1PRTN3
SCHEMBL6829507 0.77 ELANE (0.42) ELANECA1CA2FOLH1PRTN3
SCHEMBL6829374 0.74 MAPT (0.47) ELANECA1CA2FOLH1DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6737416-B2 THROMBOLYTIC AGENT HAVING HIGHER SAFETY MEIJI SEIKA KAISHA LTD. (JP) 2004-05-18 — — US disclosed
US-20030119787-A1 Phosphonic acid derivative having inhibitory activity against carboxypeptidase B MEIJI SEIKA KAISHA LTD. (JP) 2003-06-26 — — US disclosed
US-6576627-B1 Such as 7-amino-2-((2-methyl-1-(3-phenylpropanoylamino)-propyl)hydroxyphosphinoyl) -methylheptanoic acid; thrombotic disease MEIJI SEIKA KAISHA LTD. (JP) 2003-06-10 — — US disclosed
EP-1152004-B1 Phosphonic acid derivatives having carboxypeptidase B inhibitory action MEIJI SEIKA KAISHA (JP) 2003-05-07 — — EP disclosed
EP-1174434-A1 Phosphonic acid derivative having inhibitory activity against carboxypeptidase B MEIJI SEIKA KAISHA LTD. (JP) 2002-01-23 — — EP disclosed
EP-1152004-A1 PHOSPHONIC ACID DERIVATIVES HAVING CARBOXYPEPTIDASE B INHIBITORY ACTIVITY MEIJI SEIKA KAISHA LTD. (JP) 2001-11-07 — — 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-20030119787-A1 Phosphonic acid derivative having inhibitory activity against carboxypeptidase B CPB1, RNPEP, CPN1 CTSD 355/4885ELANE 173/4885CA1 476/4885

“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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