SCHEMBL25703473

SCHEMBL25703473

CC(C)C(=O)Cc1ccc(CN(CCO)[C@H]2CCCC[C@@H]2N(CC(=O)O)CC(=O)O)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.33
▸ SIGMAR1 Q99720 5/20 0.32
▸ SLC18A3 Q16572 1/20 0.32
▸ SLC6A2 P23975 3/20 0.31
▸ SLC6A4 P31645 3/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ PMP22 Q01453 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL27398776 0.92 SLC18A3 (0.35) SIGMAR1SLC18A3SLC6A2SLC6A4SLC6A3
SCHEMBL23085113 0.92 SLC18A3 (0.35) SIGMAR1SLC18A3SLC6A2SLC6A4SLC6A3
SCHEMBL25703421 0.83 SIGMAR1 (0.37) SIGMAR1SLC18A3SLC6A2SLC6A4SLC6A3
SCHEMBL27403757 0.82 MEN1 (0.40) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL25703442 0.81 ATM (0.34) SIGMAR1SLC18A3SLC6A2SLC6A4SLC6A3
SCHEMBL22593578 0.79 CA2 (0.41) SIGMAR1SLC18A3MEN1KMT2AALDH1A1
SCHEMBL22815239 0.78 SLC18A3 (0.38) SIGMAR1SLC18A3MEN1KMT2AALDH1A1
SCHEMBL27398620 0.78 SLC18A3 (0.38) SIGMAR1SLC18A3MEN1KMT2AALDH1A1
SCHEMBL30329419 0.75 CA2 (0.40) SIGMAR1SLC18A3MEN1KMT2AALDH1A1
SCHEMBL25162267 0.75 SLC18A3 (0.35) SIGMAR1SLC18A3MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192853-A1 CD8 BINDING AGENTS AND USES THEREOF GENENTECH, INC. 2023-06-22 — — 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-20230192853-A1 CD8 BINDING AGENTS AND USES THEREOF CD81, CD4, HAVCR2 LTA4H 1710/4885SIGMAR1 3502/4885SLC18A3 1530/4885

“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