SCHEMBL7075232

SCHEMBL7075232

O=C(O)C(CCCc1ccccc1)CS(=O)(=O)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.60
MMP9 P14780 4/20 0.60
MMP8 P22894 4/20 0.60
MMP1 P03956 3/20 0.60
MMP3 P08254 3/20 0.60
GRIK1 P39086 1/20 0.56
FOLH1 Q04609 1/20 0.49
CYP1A2 P05177 1/20 0.47
CPB2 Q96IY4 2/20 0.46
CPA3 P15088 1/20 0.44
HPGD P15428 1/20 0.43
ALDH1A1 P00352 1/20 0.43
FPR1 P21462 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CPA1 P15085 1/20 0.42

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
SCHEMBL7075239 0.88 MMP2 (0.60) MMP2MMP9MMP8MMP1MMP3
SCHEMBL7078968 0.88 MMP2 (0.60) MMP2MMP9MMP8MMP1MMP3
SCHEMBL7052257 0.85 CPA3 (0.60) MMP2MMP9MMP8MMP1MMP3
SCHEMBL7077667 0.85 MMP2 (0.57) MMP2MMP9MMP8MMP1MMP3
SCHEMBL7079884 0.84 MMP2 (0.51) MMP2MMP9MMP8MMP1MMP3
SCHEMBL1373606 0.83 CPA3 (0.66) FOLH1CYP1A2CPB2CPA3HPGD
SCHEMBL7075141 0.82 MMP2 (0.80) MMP2MMP9MMP8MMP1MMP3
SCHEMBL1856639 0.82 GRIK1 (0.72) MMP2MMP9MMP8MMP1MMP3
SCHEMBL27499895 0.81 MMP2 (0.53) MMP2MMP9MMP8MMP1MMP3
SCHEMBL27498676 0.81 MMP2 (0.53) MMP2MMP9MMP8MMP1MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030207889-A1 Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity OWEN DAVID ALAN (GB) 2003-11-06 US disclosed
US-6566384-B1 For therapy of cancer, inflammation and inflammatory diseases, tissue degeneration, periodontal disease, ophthalmological disease, dermatological disorders, fever, cardiovascular effects, haemorrhage, coagulation and acute phase response DARWIN DISCOVERY LTD. (GB) 2003-05-20 US disclosed
US-6118001-A ANTICANCER AGENT; ANTIARTHRITIC AGENT DARWIN DISCOVERY, LTD. (GB) 2000-09-12 US disclosed
EP-0968182-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES HAVING MMP AND TNF INHIBITORY ACTIVITY Darwin Discovery Limited (GB) 2000-01-05 EP disclosed
WO-1998005635-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES HAVING MMP AND TNF INHIBITORY ACTIVITY DARWIN DISCOVERY LIMITED (GB) 1998-02-12 WO 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-20030207889-A1 Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity MMP13, MMP2, MMP9 MMP2 2/4885MMP9 3/4885MMP8 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.