SCHEMBL5397992

SCHEMBL5397992

O=C1CSC(c2cccc(Oc3ccc(Cl)c(Cl)c3)c2)N1CCN1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
ACHE P22303 2/20 0.45
KCNA5 P22460 4/20 0.44
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL5406373 0.99 ALDH1A1 (0.50) ALDH1A1LMNAMAPTNPSR1PTGS1
SCHEMBL5402527 0.91 LMNA (0.50) ALDH1A1LMNANPSR1PTGS1PTGS2
SCHEMBL5402969 0.89 ALDH1A1 (0.50) ALDH1A1LMNAMAPTNPSR1PTGS1
SCHEMBL5404017 0.89 NPSR1 (0.55) ALDH1A1LMNANPSR1PTGS1PTGS2
SCHEMBL5418650 0.87 PTGS1 (0.60) ALDH1A1LMNAMAPTNPSR1PTGS1
SCHEMBL5408875 0.84 ALDH1A1 (0.48) ALDH1A1LMNANPSR1PTGS1PTGS2
SCHEMBL5392578 0.84 CACNA1B (0.55) ALDH1A1LMNANPSR1PTGS1PTGS2
SCHEMBL5407258 0.83 CACNA1B (0.54) ALDH1A1LMNANPSR1PTGS1PTGS2
SCHEMBL5397997 0.83 MAPT (0.43) MAPTPTGS1PTGS2ACHEKCNA5
SCHEMBL5399726 0.82 ACHE (0.46) MAPTNPSR1PTGS1PTGS2ACHE

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 10 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
EP-1417187-A1 ARYL SUBSTITUTED THIAZOLIDINONES AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2004-05-12 EP disclosed
US-20030109521-A1 Aryl substituted thiazolidinones and the use thereof EURO-CELTIQUE, S.A. 2003-06-12 US disclosed
WO-2003008398-A1 ARYL SUBSTITUTED THIAZOLIDINONES AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2003-01-30 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 (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 ALDH1A1 15/4885LMNA 730/4885MAPT 162/4885
US-20040176364-A1 Aryl substituted thiazinidinones and the use thereof CACNA1S, CACNA1I, NLN ALDH1A1 26/4885LMNA 702/4885MAPT 160/4885

“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.