SCHEMBL5418650

SCHEMBL5418650

COc1ccc(Oc2cccc(C3SCC(=O)N3CCN3CCCCC3)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.60
PTGS2 P35354 1/20 0.60
KCNA5 P22460 3/20 0.52
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 3/20 0.48
MEN1 O00255 1/20 0.48
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
CHRNA7 P36544 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
HTT P42858 1/20 0.44
GFER P55789 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
SCHEMBL5404017 0.92 NPSR1 (0.55) PTGS1PTGS2ALDH1A1LMNANPSR1
SCHEMBL5402527 0.90 LMNA (0.50) PTGS1PTGS2KCNA5ALDH1A1LMNA
SCHEMBL5408875 0.89 ALDH1A1 (0.48) PTGS1PTGS2KCNA5ALDH1A1LMNA
SCHEMBL5406373 0.88 ALDH1A1 (0.50) PTGS1PTGS2KCNA5ALDH1A1LMNA
SCHEMBL5397992 0.87 ALDH1A1 (0.48) PTGS1PTGS2KCNA5ALDH1A1LMNA
SCHEMBL5402969 0.86 ALDH1A1 (0.50) PTGS1PTGS2ALDH1A1LMNANPSR1
SCHEMBL5407258 0.84 CACNA1B (0.54) PTGS1PTGS2ALDH1A1LMNAGAA
SCHEMBL5392578 0.83 CACNA1B (0.55) PTGS1PTGS2ALDH1A1LMNANPSR1
SCHEMBL5418655 0.81 PTGS1 (0.51) PTGS1PTGS2KCNA5ALDH1A1GAA
SCHEMBL5156178 0.81 NPSR1 (0.52) PTGS1PTGS2ALDH1A1LMNANPSR1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7169782-B2 Aryl substituted thiazolidinones and the use thereof EURO-CELTIQUE S.A. (LU) 2007-01-30 US claimed
US-20040176364-A1 Aryl substituted thiazinidinones and the use thereof EURO-CELTIQUE S.A. (LU) 2004-09-09 US claimed
EP-1417187-A1 ARYL SUBSTITUTED THIAZOLIDINONES AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2004-05-12 EP claimed
US-20030109521-A1 Aryl substituted thiazolidinones and the use thereof EURO-CELTIQUE, S.A. 2003-06-12 US claimed
WO-2003008398-A1 ARYL SUBSTITUTED THIAZOLIDINONES AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2003-01-30 WO claimed
US-7169782-B2 Aryl substituted thiazolidinones and the use thereof EURO-CELTIQUE S.A. (LU) 2007-01-30 US disclosed
US-20040176364-A1 Aryl substituted thiazinidinones and the use thereof EURO-CELTIQUE S.A. (LU) 2004-09-09 US disclosed
US-20030109521-A1 Aryl substituted thiazolidinones and the use thereof EURO-CELTIQUE, S.A. 2003-06-12 US 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 (2 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-20030109521-A1 Aryl substituted thiazolidinones and the use thereof CACNA1S, CACNA1I, CACNA1C PTGS1 789/4885PTGS2 1821/4885KCNA5 344/4885
US-20040176364-A1 Aryl substituted thiazinidinones and the use thereof CACNA1S, CACNA1I, NLN PTGS1 907/4885PTGS2 1921/4885KCNA5 371/4885

“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.