SCHEMBL633034

SCHEMBL633034

NC1CN(CC2CN(c3ccc4c(c3)NC(=O)CS4)C(=O)O2)C1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
SIGMAR1 Q99720 14/20 0.38
GAA P10253 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL633033 1.00 HTT (0.38) HTTSIGMAR1GAAALDH1A1LMNA
SCHEMBL633751 0.91 SIGMAR1 (0.41) SIGMAR1
SCHEMBL633752 0.91 SIGMAR1 (0.41) SIGMAR1
SCHEMBL3427823 0.87 HTT (0.43) HTTSIGMAR1ALDH1A1LMNA
SCHEMBL3400557 0.87 HTT (0.43) HTTSIGMAR1ALDH1A1LMNA
SCHEMBL16469444 0.87 SIGMAR1 (0.41) SIGMAR1
SCHEMBL16469443 0.87 SIGMAR1 (0.41) SIGMAR1
SCHEMBL590436 0.86 F10 (0.46) HTTGAAALDH1A1LMNA
SCHEMBL2170757 0.86 F10 (0.46) HTTGAAALDH1A1LMNA
SCHEMBL590435 0.86 F10 (0.46) HTTGAAALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505750-B2 5-aminocyclylmethyl-oxazolidin-2-one derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2016-11-29 US disclosed
EP-2245028-B1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-02-22 EP disclosed
US-20110003789-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2011-01-06 US 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-20110003789-A1 5-AMINOCYCLYLMETHYL-OXAZOLIDIN-2-ONE DERIVATIVES CNKSR1, KCNH1, CBR3 HTT 2861/4885SIGMAR1 28/4885GAA 4344/4885

“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.