SCHEMBL6080320

SCHEMBL6080320

CCOC(=O)C(C(=O)OCC)=C1SCC(=O)N1CC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.43
▸ ALDH1A1 P00352 5/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ HSD17B10 Q99714 5/20 0.40
▸ HTT P42858 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ BLM P54132 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36

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
SCHEMBL3905980 0.81 MAPT (0.48) MAPK1NPSR1ALDH1A1MEN1KMT2A
SCHEMBL3905983 0.81 MAPT (0.48) MAPK1NPSR1ALDH1A1MEN1KMT2A
SCHEMBL13537540 0.72 KMT2A (0.43) MAPK1NPSR1ALDH1A1MEN1KMT2A
SCHEMBL23793685 0.71 MAPT (0.45) MAPK1NPSR1ALDH1A1MEN1KMT2A
SCHEMBL13899728 0.71 MAPK1 (0.75) MAPK1NPSR1ALDH1A1MEN1KMT2A
SCHEMBL13537423 0.71 MAPK1 (0.36) MAPK1NPSR1ALDH1A1MEN1KMT2A
SCHEMBL6086787 0.71 MAPT (0.46) MAPK1ALDH1A1MEN1KMT2AMAPT
SCHEMBL14574219 0.69 MAPT (0.44) MAPK1NPSR1ALDH1A1MEN1KMT2A
SCHEMBL6081224 0.69 KMT2A (0.56) MAPK1ALDH1A1MEN1KMT2AMAPT
SCHEMBL3904192 0.68 PLK1 (0.50) MAPK1ALDH1A1MEN1KMT2AMAPT

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-20060079503-A1 Thiazolidinones and the use therof as polo-like kinase inhibitors SCHERING AKTIENGESELLSCHAFT 2006-04-13 — — US disclosed
CN-1649853-A Thiazolidinones compound, its preparing method and use as medicine SCHERING AG (DE) 2005-08-03 — — CN disclosed
EP-1501794-A1 THIAZOLIDINONES AND THE USE THEREOF AS POLO-LIKE KINASE INHIBITORS Schering Aktiengesellschaft (DE) 2005-02-02 — — EP disclosed
WO-2003093249-A1 THIAZOLIDINONES AND THE USE THEREOF AS POLO-LIKE KINASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2003-11-13 — — 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-20060079503-A1 Thiazolidinones and the use therof as polo-like kinase inhibitors PLK4, PLK2, PLK3 MAPK1 1221/4885NPSR1 4260/4885ALDH1A1 2553/4885

“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.

Send feedback