SCHEMBL7078071

SCHEMBL7078071

CN1C(=O)N(CCCC(CS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C(=O)O)C(=O)C1(C)C

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 17/20 0.58
MMP9 P14780 17/20 0.49
MMP1 P03956 11/20 0.49
MMP3 P08254 2/20 0.40
MMP13 P45452 1/20 0.40
PLA2G7 Q13093 2/20 0.39
MMP8 P22894 1/20 0.38

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
SCHEMBL7080614 0.82 MMP2 (0.42) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7080694 0.78 MMP2 (0.47) MMP2MMP9MMP1MMP3MMP8
SCHEMBL6952582 0.77 MMP2 (0.38) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7077657 0.74 PLA2G7 (0.46) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6948525 0.74 PLA2G7 (0.54) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7568536 0.73 MMP2 (0.90) MMP2MMP9MMP1MMP3
SCHEMBL7507327 0.73 MMP2 (0.90) MMP2MMP9MMP1MMP3
SCHEMBL7676418 0.73 MMP2 (1.00) MMP2MMP9MMP1
SCHEMBL6788586 0.72 MMP2 (0.47) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7075454 0.72 POLB (0.46) MMP2MMP9MMP1MMP3MMP13

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
US-20030207889-A1 Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity OWEN DAVID ALAN (GB) 2003-11-06 US claimed
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 3/4885MMP1 16/4885

“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.