SCHEMBL6829468

SCHEMBL6829468

O=C(NCCCCCCC(O)C(=O)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.62
HTT P42858 1/20 0.62
FOLH1 Q04609 4/20 0.59
LMNA P02545 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
DPP8 Q6V1X1 1/20 0.57
DPP7 Q9UHL4 1/20 0.57
KEAP1 Q14145 2/20 0.56
NFE2L2 Q16236 2/20 0.56
MMP2 P08253 1/20 0.56
MMP9 P14780 1/20 0.56
ANPEP P15144 1/20 0.55

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
SCHEMBL6827180 0.92 TGM2 (0.62) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL6827355 0.92 TGM2 (0.62) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL6827174 0.92 TGM2 (0.62) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL11758185 0.91 HTT (0.58) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL318935 0.90 HTT (0.63) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL318936 0.90 HTT (0.63) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL6827224 0.90 HTT (0.63) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL25961940 0.89 TGM2 (0.65) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL16219553 0.89 TGM2 (0.65) TGM2HTTFOLH1LMNASMN1; SMN2
SCHEMBL15346534 0.87 HTT (0.79) TGM2HTTFOLH1LMNASMN1; SMN2

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 TGM2 903/4885HTT 3437/4885FOLH1 73/4885

“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.