SCHEMBL29655162

SCHEMBL29655162

O=C(Nc1ccc(Oc2ccc(Cl)cc2)c(Cl)c1)c1cc(Cl)ccc1O

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 17/20 0.82
STK39 Q9UEW8 3/20 0.76
MEN1 O00255 1/20 0.67
HSPD1 P10809 1/20 0.67
PIK3CA P42336 1/20 0.67
HTT P42858 1/20 0.67
BLM P54132 1/20 0.67
HSPE1 P61604 1/20 0.67
KMT2A Q03164 1/20 0.67
P2RX1 P51575 1/20 0.66

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
SCHEMBL24438027 1.00 PNLIP (0.82) PNLIPSTK39MEN1HSPD1PIK3CA
SCHEMBL24438299 0.93 PNLIP (0.80) PNLIPSTK39
SCHEMBL30692665 0.93 PNLIP (0.80) PNLIPSTK39
SCHEMBL23685884 0.91 PNLIP (0.83) PNLIPSTK39MEN1HSPD1PIK3CA
SCHEMBL23685789 0.89 PNLIP (1.00) PNLIPSTK39
SCHEMBL30692660 0.87 P2RX1 (0.82) PNLIPSTK39P2RX1
SCHEMBL24438051 0.87 P2RX1 (0.82) PNLIPSTK39P2RX1
SCHEMBL29655258 0.86 PNLIP (0.83) PNLIPSTK39MEN1HSPD1PIK3CA
SCHEMBL24438029 0.86 PNLIP (0.83) PNLIPSTK39MEN1HSPD1PIK3CA
SCHEMBL31485717 0.85 PNLIP (0.61) PNLIPSTK39

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230406831-A1 COMPOUNDS AND METHODS OF INHIBITING BACTERIAL CHAPERONIN SYSTEMS THE TRUSTEES OF INDIANA UNIVERSITY 2023-12-21 US disclosed
EP-4243799-A1 COMPOUNDS AND METHODS OF INHIBITING BACTERIAL CHAPERONIN SYSTEMS The Trustees of Indiana University (US) 2023-09-20 EP disclosed
WO-2022103572-A1 COMPOUNDS AND METHODS OF INHIBITING BACTERIAL CHAPERONIN SYSTEMS THE TRUSTEES OF INDIANA UNIVERSITY (US) 2022-05-19 WO 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-20230406831-A1 COMPOUNDS AND METHODS OF INHIBITING BACTERIAL CHAPERONIN SYSTEMS HSP90B1, HSPBP1, HSP90AB1 PNLIP 841/4885STK39 3354/4885MEN1 4702/4885

“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.