SCHEMBL3918889

SCHEMBL3918889

COC(=O)c1c(O)cccc1OCCCCNC(=O)/C(=C\c1ccc(N2CC(=O)NS2(=O)=O)c(OCc2ccccc2)c1)NC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 16/20 0.39
PTPN2 P17706 3/20 0.35
PTPRA P18433 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PTPRF P10586 1/20 0.34
PTPN22 Q9Y2R2 2/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
KMT2A Q03164 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
SCHEMBL3918892 1.00 PTPN1 (0.39) PTPN1PTPN2PTPRAALDH1A1HPGD
SCHEMBL3918895 1.00 PTPN1 (0.39) PTPN1PTPN2PTPRAALDH1A1HPGD
SCHEMBL3915722 0.96 ALDH1A1 (0.35) PTPN1ALDH1A1HPGDL3MBTL1DRD2
SCHEMBL3915717 0.96 ALDH1A1 (0.35) PTPN1ALDH1A1HPGDL3MBTL1DRD2
SCHEMBL3915720 0.96 ALDH1A1 (0.35) PTPN1ALDH1A1HPGDL3MBTL1DRD2
SCHEMBL3918228 0.81 PTPN1 (0.41) PTPN1ALDH1A1HPGDL3MBTL1KMT2A
SCHEMBL3918224 0.81 PTPN1 (0.41) PTPN1ALDH1A1HPGDL3MBTL1KMT2A
SCHEMBL3918225 0.81 PTPN1 (0.41) PTPN1ALDH1A1HPGDL3MBTL1KMT2A
SCHEMBL3921013 0.81 MCL1 (0.42) PTPN1ALDH1A1HPGDL3MBTL1KMT2A
SCHEMBL3921009 0.81 MCL1 (0.42) PTPN1ALDH1A1HPGDL3MBTL1KMT2A

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-8084448-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-20090181928-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-07-16 US disclosed
EP-2038267-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE Novartis AG (CH) 2009-03-25 EP disclosed
WO-2007115058-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE NOVARTIS AG (CH) 2007-10-11 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-20090181928-A1 ORGANIC COMPOUNDS PTPRS, PTPRO, PTPRC PTPN1 21/4885PTPN2 5/4885PTPRA 8/4885

“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.