SCHEMBL29655309

SCHEMBL29655309

O=C(Nc1ccc(Sc2nc3ccccc3s2)c(Cl)c1)c1cc(Cl)ccc1O

nearest known ligand 0.79

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 11/20 0.79
▸ HSPD1 P10809 4/20 0.71
▸ HSPE1 P61604 4/20 0.71
▸ MAPT P10636 3/20 0.57
▸ GAA P10253 2/20 0.57
▸ POLB P06746 1/20 0.57
▸ LMNA P02545 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ ALOX12 P18054 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ TMPRSS4 Q9NRS4 1/20 0.51
▸ DHODH Q02127 1/20 0.49

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
SCHEMBL24438031 1.00 CTSD (0.79) CTSDHSPD1HSPE1MAPTGAA
SCHEMBL24118857 0.91 HSPD1 (0.78) CTSDHSPD1HSPE1MAPTGAA
SCHEMBL24118859 0.91 HSPD1 (0.79) CTSDHSPD1HSPE1MAPTGAA
SCHEMBL331402 0.88 CTSD (0.80) CTSDHSPD1HSPE1MAPTGAA
SCHEMBL24438030 0.87 CTSD (0.77) CTSDHSPD1HSPE1TMPRSS4
SCHEMBL29655142 0.87 CTSD (0.73) CTSDHSPD1HSPE1MAPTPOLB
SCHEMBL24438037 0.87 CTSD (0.73) CTSDHSPD1HSPE1MAPTPOLB
SCHEMBL24118877 0.84 CTSD (0.72) CTSDHSPD1HSPE1MAPTGAA
SCHEMBL24118858 0.83 HSPD1 (1.00) CTSDHSPD1HSPE1MAPTGAA
SCHEMBL24118874 0.82 HSPD1 (1.00) CTSDHSPD1HSPE1

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 CTSD 2648/4885HSPD1 10/4885HSPE1 5/4885

“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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