SCHEMBL6432360

SCHEMBL6432360

O=C(O)c1c(NC2CCCCO2)sc2c1C1CN(CCO1)C2

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.32
NOD1 Q9Y239 1/20 0.32
POLB P06746 1/20 0.31
CASP6 P55212 1/20 0.31
RAB7A P51149 1/20 0.31
PTPN1 P18031 1/20 0.30

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
SCHEMBL7029267 0.87 KMT2A (0.33) KMT2ANOD1POLBCASP6RAB7A
SCHEMBL7849798 0.73 KMT2A (0.38) KMT2ANOD1POLB
SCHEMBL7855098 0.73 PTPN2 (0.58) KMT2ANOD1POLBCASP6PTPN1
SCHEMBL7693899 0.73 PTPN1 (0.53) KMT2ANOD1POLBCASP6PTPN1
SCHEMBL7031718 0.72 ALDH1A1 (0.40) POLB
SCHEMBL7854135 0.70 PTPN1 (0.58) KMT2ANOD1POLBCASP6RAB7A
SCHEMBL6437604 0.69 PTPN1 (0.38) POLBPTPN1
SCHEMBL4449756 0.69 PTPN1 (0.55) KMT2ANOD1POLBCASP6PTPN1
SCHEMBL6432093 0.69 PTPN2 (0.34) POLBPTPN1
SCHEMBL7167862 0.68 NPSR1 (0.52) KMT2APOLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1404682-B1 METHOD OF INHIBITING PTP 1B AND/OR T-CELL PTP AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 NOVO NORDISK AS (DK) 2005-09-14 EP disclosed
US-20030064979-A1 Method of inhibiting PTP 1B and /or T-cell PTP and/or other PTPases with an Asp residue at position 48 NOVO NORDISK A/S (DK) 2003-04-03 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-20030064979-A1 Method of inhibiting PTP 1B and /or T-cell PTP and/or other PTPases with an Asp residue at position 48 PTPRO, PTPRF, PTPA KMT2A 3893/4885NOD1 1041/4885POLB 1573/4885

“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.