SCHEMBL4936664

SCHEMBL4936664

CC(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR55 Q9Y2T6 6/20 0.58
CNR1 P21554 3/20 0.58
SLC6A9 P48067 4/20 0.56
ALDH1A1 P00352 4/20 0.52
MAPT P10636 4/20 0.52
HTT P42858 3/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TSHR P16473 1/20 0.49
MEN1 O00255 1/20 0.47
CNR2 P34972 1/20 0.47
KMT2A Q03164 1/20 0.47
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45

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
SCHEMBL4933835 0.89 SLC6A9 (0.70) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL4935920 0.88 GPR55 (0.53) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL4939869 0.87 GPR55 (0.59) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL3919015 0.82 SLC6A9 (0.79) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL3919675 0.81 SLC6A9 (0.57) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL4938526 0.80 SLC6A9 (0.58) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL4934646 0.79 SLC6A9 (0.72) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL4939424 0.78 SLC6A9 (0.56) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL4933405 0.78 SLC6A9 (0.64) GPR55CNR1SLC6A9ALDH1A1MAPT
SCHEMBL3921067 0.78 SLC6A9 (0.84) GPR55SLC6A9

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 6 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
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 GPR55 395/4885CNR1 351/4885SLC6A9 22/4885

“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.