SCHEMBL4140604

SCHEMBL4140604

O=C(O)Cc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4ccccc4)cc3)S2)cc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.40
ALOX5 P09917 12/20 0.40
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
GFER P55789 1/20 0.36
PTPN22 Q9Y2R2 1/20 0.36
EGFR P00533 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NLRP3 Q96P20 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
SCHEMBL4140602 1.00 AKR1B1 (0.40) AKR1B1ALOX5MEN1KMT2ANPC1
SCHEMBL4132443 0.83 FFAR1 (0.47) AKR1B1ALOX5GAAHTT
SCHEMBL4132445 0.83 FFAR1 (0.47) AKR1B1ALOX5GAAHTT
SCHEMBL4137073 0.82 ALOX5 (0.40) AKR1B1ALOX5MEN1KMT2APOLB
SCHEMBL4634749 0.78 ALOX5 (0.52) ALOX5MEN1KMT2APTPN22TDP1
SCHEMBL4634747 0.78 ALOX5 (0.52) ALOX5MEN1KMT2APTPN22TDP1
SCHEMBL4137078 0.78 PDE4B (0.45) AKR1B1ALOX5PTPN22HTTNLRP3
SCHEMBL4129697 0.77 ALOX5 (0.45) AKR1B1ALOX5MEN1KMT2ANLRP3
SCHEMBL4129701 0.77 ALOX5 (0.45) AKR1B1ALOX5MEN1KMT2ANLRP3
Propionic Acid SCHEMBL4128553 0.77 ALOX5 (0.46) AKR1B1ALOX5MEN1KMT2APOLB

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
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
EP-1934192-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS Torrent Pharmaceuticals Ltd (IN) 2008-06-25 EP disclosed
WO-2007032028-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS TORRENT PHARMACEUTICALS LTD. (IN) 2007-03-22 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-20090088432-A1 Thiazolinones and Oxazolinones and their Use as Ptp1b Inhibitors PTPRF, PTPA, PTPRJ AKR1B1 982/4885ALOX5 3505/4885MEN1 4075/4885

“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.