SCHEMBL31047722

SCHEMBL31047722

COC(=O)[C@H](CS(=O)(=O)O)NC(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KYNU Q16719 1/20 0.59
ALDH1A1 P00352 1/20 0.57
ALOX15 P16050 1/20 0.57
CTSK P43235 5/20 0.53
CTSS P25774 3/20 0.52
CTSL P07711 2/20 0.52
CTSB P07858 2/20 0.52
SIRT2 Q8IXJ6 1/20 0.52
SIRT1 Q96EB6 1/20 0.52
SIRT3 Q9NTG7 1/20 0.52
TRPM8 Q7Z2W7 1/20 0.51
MMP13 P45452 2/20 0.51
CASP1 P29466 1/20 0.51
TACR1 P25103 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50

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
SCHEMBL26459466 0.89 ALDH1A1 (0.57) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL22783671 0.89 PPARA (0.53) CTSKCTSSCTSLCTSBMMP13
SCHEMBL6908663 0.85 CTSK (0.52) ALDH1A1ALOX15CTSKCTSSCTSL
SCHEMBL6912269 0.84 CTSK (0.51) ALDH1A1ALOX15CTSKCTSSCTSL
SCHEMBL345230 0.83 KYNU (0.64) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL2256830 0.83 KYNU (0.64) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL12406843 0.83 KYNU (0.64) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL7151822 0.83 ALDH1A1 (0.74) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL8170978 0.83 KYNU (0.64) KYNUALDH1A1ALOX15CTSKCTSS
SCHEMBL329686 0.83 ALDH1A1 (0.74) KYNUALDH1A1ALOX15CTSKCTSS

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-20260124317-A2 Antibody Drug Conjugates BEONE MEDICINES I GMBH (CH) 2026-05-07 US disclosed
US-20250135026-A1 Antibody Drug Conjugates BEIGENE SWITZERLAND GMBH (CH) 2025-05-01 US disclosed
CN-118450907-A Antibody drug conjugates 百济神州有限公司 2024-08-06 CN 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-20260124317-A2 Antibody Drug Conjugates SLC3A2, SLC7A1, SLC43A1 KYNU 1108/4885ALDH1A1 1744/4885ALOX15 4647/4885
US-20250135026-A1 Antibody Drug Conjugates CD22, FCGR2A, FCGR3B KYNU 4202/4885ALDH1A1 403/4885ALOX15 3930/4885

“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.