SCHEMBL4938526

SCHEMBL4938526

CS(=O)(=O)c1ccc(N2CCC(F)(F)CC2)c(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 17/20 0.58
KCNH2 Q12809 3/20 0.51
GPR55 Q9Y2T6 2/20 0.50
CNR1 P21554 1/20 0.50
SLC6A5 Q9Y345 1/20 0.50
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL4939424 0.91 SLC6A9 (0.56) SLC6A9GPR55CNR1SLC6A5ALDH1A1
SCHEMBL4933835 0.88 SLC6A9 (0.70) SLC6A9GPR55CNR1SLC6A5ALDH1A1
SCHEMBL4939425 0.88 SLC6A9 (0.53) SLC6A9KCNH2GPR55CNR1SLC6A5
SCHEMBL4934646 0.86 SLC6A9 (0.72) SLC6A9GPR55CNR1SLC6A5ALDH1A1
SCHEMBL4937518 0.85 SLC6A9 (0.61) SLC6A9KCNH2GPR55CNR1SLC6A5
SCHEMBL4937072 0.85 SLC6A9 (0.60) SLC6A9KCNH2GPR55CNR1SLC6A5
SCHEMBL4930270 0.84 SMN1; SMN2 (0.59) SLC6A9GPR55ALDH1A1LMNAMAPT
SCHEMBL8256322 0.81 SMN1; SMN2 (0.55) SLC6A9GPR55ALDH1A1LMNAMAPT
SCHEMBL4935893 0.80 SLC6A9 (0.72) SLC6A9GPR55CNR1SLC6A5LMNA
SCHEMBL4936664 0.80 GPR55 (0.58) SLC6A9GPR55CNR1ALDH1A1LMNA

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
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
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 22/4885KCNH2 691/4885GPR55 395/4885

“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.