SCHEMBL6885390

SCHEMBL6885390

COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 19/20 0.59
MMP3 P08254 10/20 0.59
MMP2 P08253 1/20 0.55
ANPEP P15144 1/20 0.55

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
SCHEMBL6889052 0.87 MMP8 (0.66) MMP8MMP3
SCHEMBL6889057 0.87 MMP8 (0.66) MMP8MMP3
SCHEMBL6888715 0.86 MMP8 (0.62) MMP8MMP3MMP2ANPEP
SCHEMBL31685897 0.83 POLB (0.69) MMP8MMP3
SCHEMBL26616335 0.83 POLB (0.69) MMP8MMP3
SCHEMBL26616325 0.83 POLB (0.69) MMP8MMP3
SCHEMBL5960179 0.83 POLB (0.69) MMP8MMP3
SCHEMBL6873972 0.81 MMP8 (0.76) MMP8MMP3MMP2ANPEP
SCHEMBL14837362 0.80 MMP8 (0.54) MMP8MMP3
SCHEMBL6890721 0.79 MMP8 (0.58) MMP8MMP3MMP2ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6716853-B2 DEGENERATIVE JOINT DISORDERS; 2-(4'-ALKYLOXYCARBONYLAMINOBI PHENYL-4-SULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXY OR THE 4,5,6,7-TETRAHYDRO-1H-IMIDAZO(4,5-C)PYRIDINE RING; SULFONYLATION OF RING N WITH 4-NITROBIPHENYLSULFONIC ACID AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-04-06 US disclosed
US-20030199543-A1 Cyclic N-substituted alpha-imino carboxylic acids for selective inhibition of collogenase AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-10-23 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-20030199543-A1 Cyclic N-substituted alpha-imino carboxylic acids for selective inhibition of collogenase MMP1, MMP13, TIMP3 MMP8 13/4885MMP3 6/4885MMP2 5/4885

“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.