SCHEMBL4937613

SCHEMBL4937613

CS(=O)(=O)c1ccc(-c2ccc(F)cc2)c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 11/20 0.75
GPR55 Q9Y2T6 4/20 0.62
MAPT P10636 3/20 0.58
LMNA P02545 3/20 0.58
SLC6A5 Q9Y345 1/20 0.57
ALDH1A1 P00352 2/20 0.56
POLB P06746 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MAPK1 P28482 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ENPP2 Q13822 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
SCHEMBL4941079 0.88 SLC6A9 (0.75) SLC6A9GPR55MAPTLMNASLC6A5
SCHEMBL4948286 0.87 SLC6A9 (0.79) SLC6A9GPR55SMN1; SMN2MAPK1MEN1
SCHEMBL4938264 0.86 SLC6A9 (0.76) SLC6A9GPR55
SCHEMBL4940799 0.85 SLC6A9 (0.76) SLC6A9GPR55SMN1; SMN2MAPK1
SCHEMBL4941566 0.85 SLC6A9 (0.76) SLC6A9GPR55SMN1; SMN2MAPK1MEN1
SCHEMBL4422354 0.85 SLC6A9 (1.00) SLC6A9GPR55
SCHEMBL4938017 0.84 SLC6A9 (0.74) SLC6A9GPR55MEN1KMT2A
SCHEMBL4943078 0.84 SLC6A9 (0.79) SLC6A9GPR55
SCHEMBL4941678 0.83 SLC6A9 (0.73) SLC6A9GPR55MAPTLMNAALDH1A1
SCHEMBL4941604 0.83 SLC6A9 (0.84) SLC6A9GPR55

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-20080255144-A1 Acylated Piperidines as Glycine Transporter Inhibitors GLAXO GROUP LIMITED 2008-10-16 US disclosed
US-20080255144-A1 Acylated Piperidines as Glycine Transporter Inhibitors GLAXO GROUP LIMITED 2008-10-16 US disclosed
EP-1858869-A1 ACYLATED PIPERIDINES AS GLYCINE TRANSPORTER INHIBITORS GLAXO GROUP LIMITED (GB) 2007-11-28 EP disclosed
WO-2006094842-A1 ACYLATED PIPERIDIHES AS GLYCINE TRANSPORTER 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-20080255144-A1 Acylated Piperidines as Glycine Transporter Inhibitors SLC1A1, SLC6A7, SLC1A2 SLC6A9 9/4885GPR55 485/4885MAPT 762/4885

“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.