SCHEMBL6432093

SCHEMBL6432093

O=C(O)c1c(NC2CCCCO2)sc2c1C1CCC(CCc3ccccc3)N(C2)C1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 4/20 0.34
PTPN1 P18031 4/20 0.34
POLB P06746 1/20 0.33
KCNH2 Q12809 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP2C19 P33261 1/20 0.31
FLT3 P36888 1/20 0.30
GRM5 P41594 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 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
SCHEMBL6437604 0.82 PTPN1 (0.38) PTPN2PTPN1POLBALDH1A1GRM5
SCHEMBL7033556 0.80 ABCC1 (0.32) PTPN1POLB
SCHEMBL6439230 0.80 POLB (0.33) PTPN2PTPN1POLBALDH1A1KDM4E
SCHEMBL6849591 0.79 ADORA1 (0.43) POLBKCNH2ALDH1A1MAPT
SCHEMBL7029267 0.76 KMT2A (0.33) PTPN1POLBGRM5
SCHEMBL7859688 0.73 PTPN1 (0.65) PTPN2PTPN1POLBALDH1A1CYP2C19
SCHEMBL7252517 0.73 ACE (0.33) POLBALDH1A1MAPT
SCHEMBL6413368 0.70 CXCR2 (0.41) PTPN2PTPN1ALDH1A1KDM4EMAPT
SCHEMBL6418240 0.70 GRM6 (0.40) POLBALDH1A1MAPT
SCHEMBL6432360 0.69 KMT2A (0.32) PTPN1POLB

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
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 claimed
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 claimed
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 PTPN2 36/4885PTPN1 17/4885POLB 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.