SCHEMBL6314409

SCHEMBL6314409

O=C(O)C(=O)Nc1sc2c(c1C(=O)O)CC(CNC(=O)C(Cc1c[nH]cn1)N1C(=O)c3ccccc3C1=O)OC2

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.43
ALDH1A1 P00352 3/20 0.40
HTT P42858 1/20 0.40
PTPN2 P17706 8/20 0.38
RAB7A P51149 2/20 0.36
PTPRA P18433 1/20 0.36
PTPRB P23467 2/20 0.34
PTPRC P08575 1/20 0.33
PTPRE P23469 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL6318310 0.88 ALDH1A1 (0.44) PTPN1ALDH1A1HTTPTPN2RAB7A
SCHEMBL6322191 0.85 ALDH1A1 (0.46) PTPN1ALDH1A1HTTPTPN2RAB7A
SCHEMBL7117916 0.84 ALDH1A1 (0.47) PTPN1ALDH1A1HTTPTPN2RAB7A
SCHEMBL6315441 0.82 ALDH1A1 (0.53) PTPN1ALDH1A1HTTPTPN2RAB7A
SCHEMBL6317483 0.77 ALDH1A1 (0.53) PTPN1ALDH1A1PTPN2RAB7APTPRA
SCHEMBL6322997 0.77 TSHR (0.47) PTPN1ALDH1A1PTPN2RAB7APTPRA
SCHEMBL7860022 0.75 ALDH1A1 (0.43) ALDH1A1HTTRAB7ALMNAMAPT
SCHEMBL6207147 0.75 PTPN1 (0.51) PTPN1PTPN2RAB7APTPRAPTPRB
SCHEMBL6315812 0.73 PTPN1 (0.46) PTPN1ALDH1A1HTTPTPN2RAB7A
SCHEMBL6206528 0.73 RAB7A (0.55) PTPN1ALDH1A1PTPN2RAB7APTPRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) MOLLER NIELS PETER HUNDAHL (DK) 2003-04-10 US claimed
EP-1080095-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2001-03-07 EP claimed
WO-1999046267-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 1999-09-16 WO claimed
US-6951878-B2 Benzo[b]thiophenyl or tetrahydro-benzo[b]thiophenyl modulators of protein tyrosine phosphatases (PTPases) NOVO NORDISK A/S (DK) 2005-10-04 US disclosed
US-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) MOLLER NIELS PETER HUNDAHL (DK) 2003-04-10 US disclosed
US-6410586-B1 ANTICOAGULANTS; INSULIN RESISTANCE; ANTIALLERGENS NOVO NORDISK A/S (DK) 2002-06-25 US disclosed
US-6262044-B1 CONTAINING AN AMIDE-SUBSTITUTED TETRAHYDROTHIENOPYRIDINE RING NOVO NORDISK A/S (DK) 2001-07-17 US disclosed
EP-1080095-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2001-03-07 EP disclosed
WO-1999046267-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 1999-09-16 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-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) PTPRCAP, PTPRS, PTPRA PTPN1 7/4885ALDH1A1 3737/4885HTT 511/4885

“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.