SCHEMBL6155924

SCHEMBL6155924

CC(=O)SC(CC(=O)O)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CPA1 P15085 2/20 0.51
▸ CPB1 P15086 1/20 0.51
▸ CPA3 P15088 1/20 0.51
▸ CPB2 Q96IY4 1/20 0.51
▸ MEN1 O00255 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ALPI P09923 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ PTGS1 P23219 1/20 0.46
▸ XIAP P98170 1/20 0.46
▸ SLC7A5 Q01650 1/20 0.46
▸ ALPL P05186 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ ALPG P10696 1/20 0.45
▸ LTA4H P09960 3/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ MIF P14174 1/20 0.44
▸ SLC15A1 P46059 1/20 0.44
▸ PAM P19021 1/20 0.43

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
SCHEMBL11834777 0.91 MMP12 (0.48) CPA1PTGS1TSHR
SCHEMBL11822857 0.87 PTGS1 (0.47) MEN1HPGDKMT2APTGS1TSHR
SCHEMBL9107677 0.86 CPA1 (0.55) CPA1CPB1CPA3CPB2ALPI
SCHEMBL7037470 0.83 MMP12 (0.47) MEN1HPGDKMT2ATSHR
SCHEMBL11837137 0.82 MME (0.55) MEN1KMT2A
SCHEMBL12268109 0.82 PPID (0.46) MEN1HPGDKMT2APOLBLTA4H
SCHEMBL7040817 0.82 CYP1A2 (0.54) MEN1HPGDKMT2ACYP1A2SLC15A1
SCHEMBL7290221 0.81 CPA1 (0.50) CPA1CPB1CPA3CPB2ALPI
SCHEMBL11832270 0.79 SRR (0.46) CPA1PTGS1TSHR
SCHEMBL11828266 0.79 MMP12 (0.46) PTGS1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0916654-B1 SULFONIC ESTER DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND USE THEREOF KANEKA CORP (JP) 2005-02-23 — — EP disclosed
US-20030050310-A1 Hydroxamic acid derivatives as proteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 2003-03-13 — — US disclosed
US-6479502-B1 TREATMENT OF DISEASES AND CONDITIONS RESPONSIVE TO MODULATION OF MATRIX METALLOPROTEINASE ACTIVITY BRITISH BIOTECH PHARMACEUTICALS (GB) 2002-11-12 — — US disclosed
EP-1107953-A1 HYDROXAMIC ACID DERIVATIVES AS PROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-06-20 — — EP disclosed
WO-2000012477-A1 HYDROXAMIC ACID DERIVATIVES AS PROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-03-09 — — WO disclosed
US-5136076-A Splitting of racemic 3-acetylthio-2-benzyl propionic acid by reaction with ephedrin, separation of salts, freeing of the acid and coupling with the corresponding amino acid ester SOCIETE CIVILE BIOPROJET (FR) 1992-08-04 — — 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-20030050310-A1 Hydroxamic acid derivatives as proteinase inhibitors MMP2, CTSH, TIMP3 CPA1 33/4885CPB1 71/4885CPA3 22/4885

“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