SCHEMBL5468593

SCHEMBL5468593

COc1ccc(NC(=O)c2cc(C=C3SC(=O)N(Cc4ccc(Cl)c(Cl)c4)C3=O)ccc2O)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.53
▸ ACP1 P24666 1/20 0.53
▸ MEN1 O00255 4/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ PPARG P37231 3/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ HPGD P15428 3/20 0.52
▸ MAPT P10636 3/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ ALPL P05186 1/20 0.52
▸ RECQL P46063 1/20 0.52
▸ HSD17B3 P37058 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ MITF O75030 1/20 0.47
▸ ENPP2 Q13822 2/20 0.47
▸ CA9 Q16790 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL5468590 1.00 PTPN1 (0.53) PTPN1ACP1MEN1KMT2APPARG
SCHEMBL5464093 0.91 PPARG (0.56) PTPN1ACP1MEN1KMT2APPARG
SCHEMBL5464089 0.91 PPARG (0.56) PTPN1ACP1MEN1KMT2APPARG
SCHEMBL5459797 0.91 PTPN1 (0.55) PTPN1ACP1MEN1KMT2APPARG
SCHEMBL5459794 0.91 PTPN1 (0.55) PTPN1ACP1MEN1KMT2APPARG
SCHEMBL5459305 0.91 PTPN1 (0.56) PTPN1ACP1MEN1KMT2AKDM4E
SCHEMBL5459300 0.91 PTPN1 (0.56) PTPN1ACP1MEN1KMT2AKDM4E
SCHEMBL5465400 0.91 PTPN1 (0.52) PTPN1ACP1MEN1KMT2APPARG
SCHEMBL5465404 0.91 PTPN1 (0.52) PTPN1ACP1MEN1KMT2APPARG
SCHEMBL5455255 0.89 PTPN1 (0.56) PTPN1ACP1MEN1KMT2AKDM4E

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 1 patent. 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

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 254/4885MEN1 2892/4885

“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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