SCHEMBL6829347

SCHEMBL6829347

O=C(NCCN1CCC(O)(C(=O)OCc2ccccc2)CC1)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HTT P42858 1/20 0.50
KAT2B Q92831 1/20 0.48
GAA P10253 1/20 0.48
KEAP1 Q14145 3/20 0.46
NFE2L2 Q16236 3/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
TGM2 P21980 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 1/20 0.44
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 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
SCHEMBL6827639 0.93 KCNA3 (0.50) LMNASMN1; SMN2HTTKAT2BKEAP1
SCHEMBL6827343 0.91 LMNA (0.53) LMNASMN1; SMN2HTTKAT2BGAA
SCHEMBL7159219 0.87 LMNA (0.63) LMNASMN1; SMN2HTTKAT2BGAA
SCHEMBL20718021 0.83 SMN1; SMN2 (0.58) LMNASMN1; SMN2HTTKAT2BGAA
SCHEMBL8703529 0.82 KAT2B (0.58) LMNASMN1; SMN2HTTKAT2BMAPT
SCHEMBL31287201 0.82 GAA (0.58) LMNASMN1; SMN2HTTKAT2BGAA
SCHEMBL28546176 0.82 LMNA (0.57) LMNASMN1; SMN2HTTKAT2BGAA
SCHEMBL29889010 0.82 SMN1; SMN2 (0.51) LMNASMN1; SMN2HTTKAT2BGAA
SCHEMBL27594093 0.82 LMNA (0.51) LMNASMN1; SMN2HTTKAT2BGAA
SCHEMBL6044214 0.81 MEN1 (0.57) LMNASMN1; SMN2HTTMEN1KMT2A

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 LMNA 2640/4885SMN1; SMN2 4505/4885HTT 3437/4885

“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.