SCHEMBL4136092

SCHEMBL4136092

O=C(O)CC(C(=O)O)c1ccc(NC2=NC(=O)/C(=C\c3ccc(-c4ccccc4)cc3)S2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.40
ALOX5 P09917 15/20 0.40
PTPN22 Q9Y2R2 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 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
SCHEMBL4136095 1.00 AKR1B1 (0.40) AKR1B1ALOX5PTPN22MEN1ALDH1A1
SCHEMBL4128194 0.85 ALOX5 (0.41) AKR1B1ALOX5MEN1ALDH1A1MAPT
SCHEMBL4128197 0.85 ALOX5 (0.41) AKR1B1ALOX5MEN1ALDH1A1MAPT
SCHEMBL4143920 0.85 PTGS2 (0.49) ALOX5MEN1ALDH1A1MAPTHTT
SCHEMBL4143915 0.85 PTGS2 (0.49) ALOX5MEN1ALDH1A1MAPTHTT
SCHEMBL4141291 0.82 ALOX5 (0.44) AKR1B1ALOX5MEN1ALDH1A1MAPT
SCHEMBL4141289 0.82 ALOX5 (0.44) AKR1B1ALOX5MEN1ALDH1A1MAPT
SCHEMBL4132443 0.82 FFAR1 (0.47) AKR1B1ALOX5HTT
SCHEMBL4132445 0.82 FFAR1 (0.47) AKR1B1ALOX5HTT
Propionic Acid SCHEMBL4128553 0.80 ALOX5 (0.46) AKR1B1ALOX5PTPN22MEN1ALDH1A1

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-20090088432-A1 Thiazolinones and Oxazolinones and their Use as Ptp1b Inhibitors TORRENT PHARMACEUTICALS LIMITED (IN) 2009-04-02 US claimed
EP-1934192-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS Torrent Pharmaceuticals Ltd (IN) 2008-06-25 EP claimed
WO-2007032028-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS TORRENT PHARMACEUTICALS LTD. (IN) 2007-03-22 WO claimed
US-20090088432-A1 Thiazolinones and Oxazolinones and their Use as Ptp1b Inhibitors TORRENT PHARMACEUTICALS LIMITED (IN) 2009-04-02 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 (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-20090088432-A1 Thiazolinones and Oxazolinones and their Use as Ptp1b Inhibitors PTPRF, PTPA, PTPRJ AKR1B1 982/4885ALOX5 3505/4885PTPN22 30/4885

“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.