SCHEMBL23804616

SCHEMBL23804616

CC(C)[C@@H](NC(=O)c1cccs1)C(=O)Nc1nccs1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 15/20 1.00
▸ HSPA2 P54652 6/20 1.00
▸ HSPA9 P38646 6/20 1.00
▸ HTT P42858 2/20 0.67
▸ HSPA8 P11142 2/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.67
▸ TP53 P04637 1/20 0.65
▸ L3MBTL1 Q9Y468 1/20 0.65
▸ HSPA1A P0DMV8 2/20 0.64
▸ ALDH1A1 P00352 1/20 0.60

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
SCHEMBL23804612 1.00 HSPA5 (1.00) HSPA5HSPA2HSPA9HTTHSPA8
SCHEMBL23804614 1.00 HSPA5 (1.00) HSPA5HSPA2HSPA9HTTHSPA8
SCHEMBL23818889 0.89 HSPA5 (1.00) HSPA5HSPA2HSPA9HTTHSPA8
SCHEMBL23804606 0.88 HSPA5 (0.78) HSPA5HSPA2HSPA9HTTHSPA8
SCHEMBL23804615 0.85 HSPA5 (0.74) HSPA5HSPA2HSPA9HTTHSPA8
SCHEMBL23804607 0.85 HSPA5 (0.74) HSPA5HSPA2HSPA9HTTHSPA8
SCHEMBL23804623 0.82 HSPA5 (0.72) HSPA5HSPA2HSPA9HSPA8HSPA1A
SCHEMBL23818887 0.82 HSPA5 (1.00) HSPA5HSPA2HSPA9HSPA1A
SCHEMBL23804598 0.82 HSPA5 (0.69) HSPA5HSPA2HSPA9HTTHSPA8
SCHEMBL23804601 0.82 HSPA5 (0.69) HSPA5HSPA2HSPA9HTTHSPA8

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-20230091297-A1 INHIBITORS OF HSP70 PROTEINS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2023-03-23 — — US disclosed
WO-2021183942-A1 INHIBITORS OF HSP70 PROTEINS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2021-09-16 — — 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-20230091297-A1 INHIBITORS OF HSP70 PROTEINS HSPA2, HSP90AB2P, HSP90AB1 HSPA5 14/4885HSPA2 1/4885HSPA9 19/4885

“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.

Send feedback