SCHEMBL6823763

SCHEMBL6823763

CCOC(=O)C(CCCCNC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 6/20 0.58
▸ HTT P42858 1/20 0.58
▸ MMP2 P08253 1/20 0.55
▸ MMP9 P14780 1/20 0.55
▸ TGM2 P21980 1/20 0.55
▸ DPP8 Q6V1X1 1/20 0.54
▸ DPP7 Q9UHL4 1/20 0.54
▸ SIRT2 Q8IXJ6 2/20 0.53
▸ SIRT1 Q96EB6 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ KEAP1 Q14145 1/20 0.53
▸ NFE2L2 Q16236 1/20 0.53

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
SCHEMBL6827646 0.96 HTT (0.59) FOLH1HTTMMP2MMP9TGM2
SCHEMBL11758185 0.88 HTT (0.58) FOLH1HTTMMP2MMP9TGM2
SCHEMBL30214739 0.87 L3MBTL1 (0.59) FOLH1HTTTGM2LMNASMN1; SMN2
SCHEMBL10562902 0.86 HTT (0.56) FOLH1HTTMMP2MMP9TGM2
SCHEMBL10917494 0.86 DPP8 (0.64) FOLH1HTTMMP2MMP9TGM2
SCHEMBL23542526 0.86 DPP8 (0.64) FOLH1HTTMMP2MMP9TGM2
Hydrochloric Acid SCHEMBL27139143 0.85 DPP8 (0.63) FOLH1HTTMMP2MMP9TGM2
Hydrochloric Acid SCHEMBL11023028 0.85 DPP8 (0.63) FOLH1HTTMMP2MMP9TGM2
SCHEMBL25413770 0.85 HTT (0.68) FOLH1HTTMMP2MMP9TGM2
SCHEMBL31357186 0.84 HTT (0.54) FOLH1HTTMMP2MMP9TGM2

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 FOLH1 73/4885HTT 3437/4885MMP2 108/4885

“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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