SCHEMBL15746166

SCHEMBL15746166

CC/C=C/C(=O)O[C@@H]1COC(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
XPO1 O14980 1/20 0.40
PTPN1 P18031 1/20 0.36
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL16512646 0.85 XPO1 (0.43) XPO1PTPN1
SCHEMBL15746163 0.85 XPO1 (0.43) XPO1PTPN1
SCHEMBL11427232 0.77
SCHEMBL15746169 0.76 PTPN1 (0.36) XPO1PTPN1HTT
SCHEMBL11988739 0.76 PTPN1 (0.40) XPO1PTPN1KDM4ELMNAMAPT
SCHEMBL512370 0.76 XPO1 (0.39) XPO1PTPN1HTT
SCHEMBL30590682 0.76 PTPN1 (0.40) XPO1PTPN1KDM4ELMNAMAPT
SCHEMBL4917217 0.73 PTPN1 (0.40) XPO1PTPN1KDM4ELMNAMAPT
SCHEMBL5307393 0.73 PTPN1 (0.40) XPO1PTPN1KDM4ELMNAMAPT
SCHEMBL4926758 0.73 PTPN1 (0.40) XPO1PTPN1KDM4ELMNAMAPT

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-9073884-B2 Anti-inflammatory and quorum sensing inhibition compounds and methods of making and using them THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-07-07 US disclosed
US-20140147481-A1 ANTI-INFLAMMATORY AND QUORUM SENSING INHIBITION COMPOUNDS AND METHODS OF MAKING AND USING THEM UNIVERSITY OF RHODE ISLAND RESEARCH FOUNDATION (US) 2014-05-29 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-20140147481-A1 ANTI-INFLAMMATORY AND QUORUM SENSING INHIBITION COMPOUNDS AND METHODS OF MAKING AND USING THEM CGAS, CD47, LGALS1 XPO1 2997/4885PTPN1 1613/4885KDM4E 1716/4885

“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.