SCHEMBL4133702

SCHEMBL4133702

CN(C)c1ccc(-c2ccc(C=C3SC(Nc4ccc(C(CCCCCC(=O)O)C(=O)O)cc4)=NC3=O)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ACKR3 P25106 1/20 0.37
CCR5 P51681 1/20 0.37
ALOX5 P09917 6/20 0.36
NPC1 O15118 2/20 0.36
IDE P14735 1/20 0.36
HDAC1 Q13547 3/20 0.34
LTB4R Q15722 1/20 0.34
FFAR1 O14842 1/20 0.33
POLB P06746 1/20 0.33
TNNI3 P19429 1/20 0.33
TNNT2 P45379 1/20 0.33
RAB9A P51151 1/20 0.33
GFER P55789 1/20 0.33
TNNC1 P63316 1/20 0.33
GSK3B P49841 1/20 0.33

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
SCHEMBL4133696 1.00 MEN1 (0.37) MEN1KMT2AALDH1A1GAAL3MBTL1
SCHEMBL4295178 0.85 ALOX5 (0.36) KMT2AALOX5POLB
SCHEMBL4295177 0.85 ALOX5 (0.36) KMT2AALOX5POLB
SCHEMBL4136095 0.78 AKR1B1 (0.40) MEN1KMT2AALDH1A1ALOX5
SCHEMBL4136092 0.78 AKR1B1 (0.40) MEN1KMT2AALDH1A1ALOX5
SCHEMBL4634853 0.78 ACKR3 (0.35) MEN1KMT2AACKR3CCR5ALOX5
SCHEMBL4634855 0.78 ACKR3 (0.35) MEN1KMT2AACKR3CCR5ALOX5
Acetic Acid SCHEMBL4125929 0.77 ALOX5 (0.43) MEN1KMT2AACKR3CCR5ALOX5
Acetic Acid SCHEMBL4125926 0.77 ALOX5 (0.43) MEN1KMT2AACKR3CCR5ALOX5
SCHEMBL4634771 0.76 HDAC1 (0.31) HDAC1

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 MEN1 4075/4885KMT2A 2895/4885ALDH1A1 216/4885

“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.