SCHEMBL3353294

SCHEMBL3353294

CCN1C(=O)CS/C1=C(/C#N)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ MAPT P10636 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ ALDH1A1 P00352 4/20 0.40
▸ LMNA P02545 2/20 0.40
▸ ATM Q13315 2/20 0.40
▸ DHODH Q02127 8/20 0.39
▸ GSK3A P49840 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ USP2 O75604 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ CHEK2 O96017 1/20 0.35
▸ RPS6KB1 P23443 1/20 0.35

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
SCHEMBL13488663 1.00 MEN1 (0.54) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL12307220 0.85 MEN1 (0.51) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL6087214 0.84 MEN1 (0.48) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL3905983 0.83 MAPT (0.48) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL13488664 0.83 ALDH1A1 (0.49) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL3358918 0.83 ALDH1A1 (0.49) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL3905980 0.83 MAPT (0.48) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL6086601 0.83 MEN1 (0.59) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL6086606 0.83 MEN1 (0.59) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL13488667 0.82 ALDH1A1 (0.48) MEN1KMT2AMAPTHSD17B10ALDH1A1

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
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 — — EP disclosed
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 — — US disclosed
US-20070010566-A1 Thiazolidinones without basic nitrogen, their production and use as pharmaceutical agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-11 — — US disclosed
US-20070010566-A1 Thiazolidinones without basic nitrogen, their production and use as pharmaceutical agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-11 — — US disclosed
US-20070010565-A1 New thiazolidinones without basic nitrogen, their production and use as pharmaceutical agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-11 — — US disclosed
US-20070010565-A1 New thiazolidinones without basic nitrogen, their production and use as pharmaceutical agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-11 — — 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 (3 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-20070010566-A1 Thiazolidinones without basic nitrogen, their production and use as pharmaceutical agents PLK4, PLK2, PLK3 MEN1 3128/4885KMT2A 3304/4885MAPT 225/4885
US-20070010565-A1 New thiazolidinones without basic nitrogen, their production and use as pharmaceutical agents PLK4, PLK2, PLK3 MEN1 3493/4885KMT2A 4208/4885MAPT 796/4885
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug PLK4, PDXK, PLK2 MEN1 3023/4885KMT2A 2543/4885MAPT 753/4885

“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.

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