SCHEMBL5756427

SCHEMBL5756427

CC(C)(C)OC(N)=O.O=C(O)C(CCc1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.47
CTSS P25774 1/20 0.47
PRSS1 P07477 2/20 0.45
CTSG P08311 2/20 0.45
CTRB1 P17538 2/20 0.45
CMA1 P23946 2/20 0.45
LMNA P02545 1/20 0.44
SLC7A5 Q01650 1/20 0.43
GRIK1 P39086 1/20 0.42
TSHR P16473 1/20 0.42
BLM P54132 1/20 0.41
MMP8 P22894 1/20 0.41
KMT2A Q03164 1/20 0.41
ANPEP P15144 2/20 0.41
ERAP1 Q9NZ08 2/20 0.41
ERAP2 Q6P179 1/20 0.41

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
SCHEMBL11091468 0.88 CTSK (0.45) CTSKCTSSPRSS1CTSGCTRB1
SCHEMBL7061908 0.83 CTSK (0.50) CTSKCTSSPRSS1CTSGCTRB1
SCHEMBL22042158 0.83 LMNA (0.47) CTSKCTSSPRSS1CTSGCTRB1
Phenyl Propionic Acid SCHEMBL7261317 0.81 KEAP1 (0.61) LMNA
Hydrocinnamyl Alcohol SCHEMBL5741728 0.80 LMNA (0.53) CTSSLMNAKMT2A
SCHEMBL2291948 0.80 MMP8 (0.56) TSHRMMP8ANPEPERAP1ERAP2
Ethylbenzene SCHEMBL27571280 0.79 TP53 (0.50) LMNASLC7A5TSHRKMT2A
SCHEMBL22042153 0.79 LMNA (0.51) CTSKCTSSLMNAGRIK1KMT2A
Dl-Phenylalanine SCHEMBL29077118 0.79 SLC7A5 (0.67) SLC7A5
SCHEMBL7057941 0.79 MMP1 (0.48) CTSKCTSSPRSS1CTSGCTRB1

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
EP-1208092-B1 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO LTD (KR) 2006-06-21 EP disclosed
US-6548667-B2 For prevention and treatment of diseases caused by overexpression and overactivation of matrix metalloproteinase SAMSUNG ELECTRONICS CO. LTD. (KR) 2003-04-15 US disclosed
US-20020169314-A1 Sulfonamide derivative as a matrix metalloproteinase inhibitor SAMSUNG ELECTRONICS CO. LTD. (KR) 2002-11-14 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-20020169314-A1 Sulfonamide derivative as a matrix metalloproteinase inhibitor MMP9, MMP3, MMP14 CTSK 256/4885CTSS 80/4885PRSS1 18/4885

“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.