SCHEMBL13627741

SCHEMBL13627741

COC(=O)NCC(=O)N1CCOCC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.54
ALDH1A1 P00352 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
HTT P42858 1/20 0.49
TSHR P16473 3/20 0.46
POLB P06746 2/20 0.46
LMNA P02545 1/20 0.46
FKBP1A P62942 2/20 0.45
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 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
SCHEMBL17850607 0.90 ALDH1A1 (0.46) GLAALDH1A1L3MBTL1HTTTSHR
SCHEMBL4613472 0.83 ALDH1A1 (0.58) GLAALDH1A1L3MBTL1HTTTSHR
SCHEMBL17527131 0.83 TSHR (0.49) ALDH1A1L3MBTL1TSHRGAARAB9A
SCHEMBL8353377 0.83 TSHR (0.53) ALDH1A1L3MBTL1TSHRGAARAB9A
SCHEMBL17850623 0.81 TSHR (0.55) ALDH1A1L3MBTL1TSHRGAARAB9A
SCHEMBL13135936 0.81 HTT (0.52) GLAALDH1A1L3MBTL1HTTTSHR
SCHEMBL14223107 0.81 L3MBTL1 (0.51) GLAALDH1A1L3MBTL1HTTTSHR
SCHEMBL6231400 0.80 TSHR (0.53) GLAALDH1A1L3MBTL1HTTTSHR
SCHEMBL19151104 0.79 HTT (0.53) GLAALDH1A1L3MBTL1HTTTSHR
SCHEMBL13380094 0.77 HTT (0.47) GLAALDH1A1L3MBTL1HTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
EP-2022782-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE PIPERIDINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2009-02-11 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-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS SNCA, SYNJ1, KCNH2 GLA 1215/4885ALDH1A1 2644/4885L3MBTL1 4338/4885

“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.