SCHEMBL5745658

SCHEMBL5745658

C[C@]1(O)CN(C(=O)O)CC[C@@H]1N

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.31
GNAI3 P08754 1/20 0.30
GNAO1 P09471 1/20 0.30
GNAI1 P63096 1/20 0.30
EPHX2 P34913 1/20 0.30

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
SCHEMBL6080514 1.00 SMN1; SMN2 (0.31) SMN1; SMN2GNAI3GNAO1GNAI1EPHX2
SCHEMBL4695720 0.85 SMN1; SMN2 (0.31) SMN1; SMN2GNAI3GNAO1GNAI1EPHX2
SCHEMBL22126575 0.85 SMN1; SMN2 (0.31) SMN1; SMN2GNAI3GNAO1GNAI1EPHX2
SCHEMBL12492417 0.82 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL23578669 0.81 SMN1; SMN2 (0.38) SMN1; SMN2EPHX2
SCHEMBL3861743 0.79
SCHEMBL14060491 0.77 DPP4 (0.31)
SCHEMBL26963360 0.77 DPP4 (0.31)
SCHEMBL23704748 0.77 DPP4 (0.31)
SCHEMBL23578708 0.77 GAA (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578743-A4 ANTIBACTERIAL AGENTS GLAXO GROUP LTD (GB) 2006-11-29 EP disclosed
US-20060041123-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-02-23 US disclosed
EP-1578743-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2005-09-28 EP disclosed
WO-2004058144-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2004-07-15 WO 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-20060041123-A1 Antibacterial agents NQO2, NRDC, IFNG SMN1; SMN2 2706/4885GNAI3 1165/4885GNAO1 1857/4885

“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.