SCHEMBL4698677

SCHEMBL4698677

O=C1CC(NS(=O)(=O)N2CCC(c3ccc(F)cc3)CC2)C(=O)N1OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.39
USP5 P45974 1/20 0.39
USP30 Q70CQ3 1/20 0.39
CHRM4 P08173 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
MMP3 P08254 2/20 0.36
KCNH2 Q12809 1/20 0.36
GRIN2B Q13224 1/20 0.36
CCR5 P51681 1/20 0.36
MCL1 Q07820 1/20 0.35
BCL2A1 Q16548 1/20 0.35

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
SCHEMBL4700381 0.95 SLC18A3 (0.37) SLC18A3USP5USP30CHRM4MMP3
SCHEMBL4698135 0.78 USP5 (0.44) USP5USP30MMP3KCNH2GRIN2B
SCHEMBL4700809 0.77 MMP2 (0.45) USP30MMP3MCL1
SCHEMBL4702692 0.73 MMP2 (0.46) MMP3MCL1
SCHEMBL5882183 0.72 F10 (0.44) USP30MMP3MCL1
SCHEMBL14040629 0.71 USP5 (0.46) USP5USP30MMP3KCNH2GRIN2B
SCHEMBL4698467 0.67 F10 (0.42) MMP3MCL1
SCHEMBL5882266 0.67 ALDH1A1 (0.44) USP30ALDH1A1MMP3
Hydrochloric Acid SCHEMBL4703963 0.67 F10 (0.42) ALDH1A1MMP3
SCHEMBL4698155 0.65 F10 (0.51) USP30MMP3

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-1444202-B1 NOVEL METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2008-10-15 EP disclosed
US-7132434-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2006-11-07 US disclosed
US-20050026990-A1 Novel metalloproteinase ihibitors ASTRAZENECA AB (SE) 2005-02-03 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-20050026990-A1 Novel metalloproteinase ihibitors MMP12, MMP1, MMP16 SLC18A3 4114/4885USP5 1906/4885USP30 1432/4885

“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.