SCHEMBL4940447

SCHEMBL4940447

CS(=O)(=O)c1ccc(-c2cccnc2)c(C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.59
PTGS1 P23219 4/20 0.50
LMNA P02545 2/20 0.50
KDM4E B2RXH2 1/20 0.48
HTT P42858 1/20 0.48
KMO O15229 2/20 0.46
EIF4E P06730 1/20 0.46
DHODH Q02127 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
SCHEMBL4941143 0.85 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL3875822 0.85 LMNA (0.58) PTGS2LMNA
SCHEMBL3873005 0.84 LMNA (0.54) PTGS2PTGS1LMNAEIF4E
SCHEMBL16277788 0.80 LMNA (0.56) LMNAKDM4EHTTKMOEIF4E
SCHEMBL28439295 0.78 KMO (0.64) LMNAKDM4EHTTKMOEIF4E
SCHEMBL3884199 0.78 SLC6A9 (0.53) PTGS2PTGS1LMNA
SCHEMBL17205245 0.78 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL8423019 0.78 PTGS2 (0.63) PTGS2PTGS1
SCHEMBL28111372 0.77 PTGS2 (0.58) PTGS2PTGS1
SCHEMBL4940341 0.76 LMNA (0.51) PTGS2LMNAEIF4E

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-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
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
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 PTGS2 2558/4885PTGS1 1435/4885LMNA 4248/4885

“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.