SCHEMBL5459430

SCHEMBL5459430

O=C(Nc1ccccc1)c1ccc(CN2C(=O)S/C(=C\c3ccc(O)c(O)c3)C2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 11/20 0.61
▸ ACP1 P24666 10/20 0.61
▸ ENPP2 Q13822 5/20 0.61
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ POLB P06746 1/20 0.59
▸ HSP90AA1 P07900 1/20 0.59
▸ GAA P10253 1/20 0.59
▸ CASP3 P42574 1/20 0.59
▸ SENP8 Q96LD8 1/20 0.59
▸ SENP7 Q9BQF6 1/20 0.59
▸ SENP6 Q9GZR1 1/20 0.59
▸ KDR P35968 2/20 0.58
▸ PTPN2 P17706 4/20 0.56
▸ PTPRF P10586 2/20 0.56
▸ PTPRB P23467 2/20 0.56

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
SCHEMBL5459436 1.00 PTPN1 (0.61) PTPN1ACP1ENPP2MEN1KMT2A
SCHEMBL5460326 0.87 MEN1 (0.65) PTPN1ACP1ENPP2MEN1KMT2A
SCHEMBL5460324 0.87 MEN1 (0.65) PTPN1ACP1ENPP2MEN1KMT2A
SCHEMBL15682752 0.85 MEN1 (0.78) PTPN1ACP1ENPP2MEN1KMT2A
SCHEMBL5783360 0.82 MEN1 (0.72) MEN1KMT2APOLBKDR
SCHEMBL5783365 0.82 MEN1 (0.72) MEN1KMT2APOLBKDR
SCHEMBL5469854 0.81 MEN1 (0.62) PTPN1ACP1ENPP2MEN1KMT2A
SCHEMBL5469859 0.81 MEN1 (0.62) PTPN1ACP1ENPP2MEN1KMT2A
SCHEMBL5457238 0.81 PTPN1 (0.72) PTPN1ACP1ENPP2MEN1KMT2A
SCHEMBL5457241 0.81 PTPN1 (0.72) PTPN1ACP1ENPP2MEN1KMT2A

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 PTPN1 3264/4885ACP1 254/4885ENPP2 1911/4885

“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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