SCHEMBL4936944

SCHEMBL4936944

CCCNc1ccc(S(C)(=O)=O)cc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
CISD1 Q9NZ45 6/20 0.51
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 3/20 0.48
HSD17B10 Q99714 2/20 0.48
KDM6B O15054 1/20 0.48
KDM4C Q9H3R0 1/20 0.48
HCAR3 P49019 1/20 0.47
KMT2A Q03164 1/20 0.45
APEX1 P27695 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
METAP2 P50579 4/20 0.44
PKM P14618 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL4936935 0.86 LMNA (0.44) LMNACISD1KDM4EALDH1A1HSD17B10
SCHEMBL10993015 0.80 S1PR3 (0.55) LMNACISD1KDM4EALDH1A1HSD17B10
SCHEMBL17629883 0.80 LMNA (0.60) LMNAKDM4EALDH1A1HSD17B10HPGD
SCHEMBL17938288 0.78 HCAR3 (0.62) CISD1KDM4EALDH1A1KDM6BKDM4C
SCHEMBL15639856 0.77 KDM4E (0.59) CISD1KDM4EALDH1A1HSD17B10KDM6B
SCHEMBL8991944 0.77 KDM6B (0.51) CISD1KDM4EALDH1A1HSD17B10KDM6B
SCHEMBL16690808 0.77 LMNA (0.61) LMNAKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL15635660 0.77 APEX1 (0.72) CISD1KDM4EALDH1A1KDM6BKDM4C
SCHEMBL5712355 0.77 PTPRC (0.55) CISD1KDM4EALDH1A1HSD17B10KDM6B
SCHEMBL3319072 0.76 KDM4E (0.53) LMNAKDM4EALDH1A1HSD17B10HCAR3

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 LMNA 4438/4885CISD1 1378/4885KDM4E 2626/4885

“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.