SCHEMBL23572622

SCHEMBL23572622

CSCCC(NC(=O)C(CCC(=O)O)NC(=O)C(C)NC(C)=O)C(=O)N1CCCC1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CXCL8 P10145 10/20 0.48
▸ NAA50 Q9GZZ1 1/20 0.44
▸ BACE1 P56817 4/20 0.43
▸ ACE P12821 2/20 0.43
▸ REN P00797 1/20 0.43
▸ CTSL P07711 3/20 0.41
▸ CTSS P25774 3/20 0.41
▸ CTSK P43235 3/20 0.41
▸ CTSH P09668 1/20 0.41
▸ BACE2 Q9Y5Z0 1/20 0.39

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
SCHEMBL23572623 1.00 CXCL8 (0.48) CXCL8NAA50BACE1ACEREN
SCHEMBL23572621 1.00 CXCL8 (0.48) CXCL8NAA50BACE1ACEREN
SCHEMBL16557291 0.84 PPID (0.42) NAA50
SCHEMBL30262155 0.83 GRB2 (0.43) CXCL8CTSLCTSSCTSKCTSH
SCHEMBL23601291 0.82 NMUR2 (0.44) CXCL8CTSLCTSSCTSKCTSH
SCHEMBL23572612 0.82 NMUR2 (0.44) CXCL8CTSLCTSSCTSKCTSH
SCHEMBL23572613 0.82 NMUR2 (0.44) CXCL8CTSLCTSSCTSKCTSH
SCHEMBL23572611 0.82 NMUR2 (0.44) CXCL8CTSLCTSSCTSKCTSH
SCHEMBL29640706 0.81 NAA50 (0.45) CXCL8NAA50
SCHEMBL31497326 0.79 CALCRL (0.46) CXCL8

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-11925643-B2 Toll-like receptor 4 (TLR4) inhibitors and use thereof MOR RESEARCH APPLICATIONS LTD. (IL) 2024-03-12 — — US disclosed
US-20210196717-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF BAR-ILAN UNIVERSITY (IL) 2021-07-01 — — US disclosed
US-20210196717-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF BAR-ILAN UNIVERSITY (IL) 2021-07-01 — — 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 (2 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-11925643-B2 Toll-like receptor 4 (TLR4) inhibitors and use thereof TLR4, TLR1, TLR3 CXCL8 922/4885NAA50 4428/4885BACE1 1619/4885
US-20210196717-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF TLR4, TLR1, TLR3 CXCL8 922/4885NAA50 4428/4885BACE1 1619/4885

“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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