SCHEMBL5462986

SCHEMBL5462986

O=C(O)c1cc(/C=C2\SC(=O)N(Cc3ccc(-c4ccccc4)cc3)C2=O)ccc1O

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 11/20 0.65
ACP1 P24666 11/20 0.65
PPARG P37231 1/20 0.61
NLRP3 Q96P20 1/20 0.58
AKR1B1 P15121 1/20 0.57
PTPN2 P17706 4/20 0.57
ENPP2 Q13822 3/20 0.57
PTPRF P10586 2/20 0.57
PTPRB P23467 2/20 0.57
MEN1 O00255 1/20 0.55
POLB P06746 1/20 0.55
HSP90AA1 P07900 1/20 0.55
GAA P10253 1/20 0.55
CASP3 P42574 1/20 0.55
KMT2A Q03164 1/20 0.55
SENP8 Q96LD8 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55

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
SCHEMBL5462991 1.00 PTPN1 (0.65) PTPN1ACP1PPARGNLRP3AKR1B1
SCHEMBL5460435 0.87 PTPN1 (0.60) PTPN1ACP1PPARGNLRP3PTPN2
SCHEMBL5460437 0.87 PTPN1 (0.60) PTPN1ACP1PPARGNLRP3PTPN2
SCHEMBL5463880 0.86 PTPN1 (0.60) PTPN1ACP1PPARGPTPN2ENPP2
SCHEMBL5463879 0.86 PTPN1 (0.60) PTPN1ACP1PPARGPTPN2ENPP2
SCHEMBL5462486 0.86 CFTR (0.62) PTPN1ACP1PPARGNLRP3PTPN2
SCHEMBL5462482 0.86 CFTR (0.62) PTPN1ACP1PPARGNLRP3PTPN2
SCHEMBL5469842 0.85 MAPK1 (0.62) PTPN1ACP1AKR1B1ENPP2MEN1
SCHEMBL5469841 0.85 MAPK1 (0.62) PTPN1ACP1AKR1B1ENPP2MEN1
SCHEMBL5466747 0.84 ENPP2 (0.58) PTPN1ACP1NLRP3PTPN2ENPP2

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 254/4885PPARG 1078/4885

“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.