SCHEMBL4934646

SCHEMBL4934646

CS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 13/20 0.72
SLC6A5 Q9Y345 7/20 0.67
MAPT P10636 3/20 0.56
ALDH1A1 P00352 2/20 0.56
IDE P14735 1/20 0.55
AKR1C3 P42330 1/20 0.53
LMNA P02545 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CNR1 P21554 1/20 0.52
GPR55 Q9Y2T6 1/20 0.52
PAX8 Q06710 1/20 0.51

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
SCHEMBL4935893 0.91 SLC6A9 (0.72) SLC6A9SLC6A5MAPTIDELMNA
SCHEMBL4930244 0.91 SLC6A9 (0.82) SLC6A9SLC6A5IDEAKR1C3GPR55
SCHEMBL4933835 0.90 SLC6A9 (0.70) SLC6A9SLC6A5MAPTALDH1A1LMNA
SCHEMBL4938614 0.90 SLC6A9 (0.67) SLC6A9SLC6A5IDE
SCHEMBL4938266 0.89 SLC6A9 (0.77) SLC6A9SLC6A5IDE
SCHEMBL4939899 0.89 SLC6A9 (0.71) SLC6A9SLC6A5MAPTALDH1A1IDE
SCHEMBL4936736 0.89 SLC6A9 (0.73) SLC6A9SLC6A5IDEAKR1C3CNR1
SCHEMBL4939090 0.87 SLC6A9 (0.66) SLC6A9SLC6A5MAPTIDEPAX8
SCHEMBL4939424 0.87 SLC6A9 (0.56) SLC6A9SLC6A5MAPTALDH1A1LMNA
SCHEMBL4934753 0.87 SLC6A9 (0.74) SLC6A9SLC6A5MAPTALDH1A1IDE

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-20080090822-A1 Piperazine Derivatives As Glyt 1 Inhibitors GLAXO GROUP LIMITED 2008-04-17 US disclosed
US-20080090822-A1 Piperazine Derivatives As Glyt 1 Inhibitors GLAXO GROUP LIMITED 2008-04-17 US disclosed
US-20080090822-A1 Piperazine Derivatives As Glyt 1 Inhibitors GLAXO GROUP LIMITED 2008-04-17 US disclosed
EP-1856077-A1 PIPERAZINE DERIVATIVES AS GLYT1 INHIBITORS GLAXO GROUP LIMITED (GB) 2007-11-21 EP disclosed
WO-2006094843-A1 PIPERAZINE DERIVATIVES AS GLYT1 INHIBITORS GLAXO GROUP LIMITED (GB) 2006-09-14 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-20080090822-A1 Piperazine Derivatives As Glyt 1 Inhibitors SLC6A7, SLC6A5, SLC1A2 SLC6A9 22/4885SLC6A5 2/4885MAPT 441/4885

“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.