SCHEMBL5468835

SCHEMBL5468835

Nc1cccc(C=C2SC(=O)N(Cc3ccc(Cl)c(Cl)c3)C2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.56
▸ PTPN1 P18031 5/20 0.55
▸ ACP1 P24666 5/20 0.55
▸ ENPP2 Q13822 4/20 0.54
▸ PPARG P37231 3/20 0.53
▸ PIM1 P11309 1/20 0.53
▸ PTPN2 P17706 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL5468833 1.00 AKR1B1 (0.56) AKR1B1PTPN1ACP1ENPP2PPARG
SCHEMBL5461751 0.84 ENPP2 (0.77) PTPN1ACP1ENPP2PTPN2PKM
SCHEMBL5461748 0.84 ENPP2 (0.77) PTPN1ACP1ENPP2PTPN2PKM
SCHEMBL5459960 0.83 MAPK1 (0.69) AKR1B1PPARGPKMMAPK1NPSR1
SCHEMBL5459959 0.83 MAPK1 (0.69) AKR1B1PPARGPKMMAPK1NPSR1
SCHEMBL5465473 0.80 ENPP2 (0.58) PTPN1ACP1ENPP2PPARGPTPN2
SCHEMBL5465471 0.80 ENPP2 (0.58) PTPN1ACP1ENPP2PPARGPTPN2
SCHEMBL5460169 0.80 PTPN1 (0.53) PTPN1ACP1ENPP2PPARGMAPK1
SCHEMBL5460170 0.80 PTPN1 (0.53) PTPN1ACP1ENPP2PPARGMAPK1
SCHEMBL6687446 0.79 PPARG (0.67) PTPN1ACP1ENPP2PPARG

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
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 — — US disclosed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 — — EP 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 AKR1B1 1236/4885PTPN1 3264/4885ACP1 254/4885

“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.

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