SCHEMBL6923709

SCHEMBL6923709

CC(=O)C1CNCCN1S(=O)(=O)c1ccccc1S(=O)(=O)Oc1cc(C)cc(O)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F2 P00734 15/20 0.40
MMP1 P03956 4/20 0.40
MMP9 P14780 4/20 0.40
MMP13 P45452 4/20 0.40
MMP3 P08254 1/20 0.40
MMP7 P09237 1/20 0.40
F10 P00742 1/20 0.38
PRSS2 P07478 1/20 0.38
ADAM17 P78536 1/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
CTRC Q99895 1/20 0.34

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
SCHEMBL6929248 0.87 F2 (0.46) F2F10PRSS2CTRC
SCHEMBL6750001 0.87 F2 (0.46) F2F10PRSS2CTRC
SCHEMBL6746026 0.85 F2 (0.49) F2F10PRSS2CTRC
SCHEMBL6749117 0.82 F2 (0.44) F2F10PRSS2CTRC
SCHEMBL6852888 0.81 F2 (0.47) F2F10PRSS2CTRC
Hydrochloric Acid SCHEMBL6745810 0.81 F2 (0.46) F2F10PRSS2CTRC
SCHEMBL6745617 0.77 MMP1 (0.43) MMP1MMP9MMP13MMP3MMP7
SCHEMBL6745848 0.74 MMP1 (0.43) MMP1MMP9MMP13MMP3MMP7
SCHEMBL6750484 0.72 F2 (0.36) F2F10PRSS2CTRC
SCHEMBL6749672 0.72 NPC1 (0.49)

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-6518310-B2 Non-peptidic; inhibits trypsin-like protease, thrombin and embolus formation; anticoagulant 3-DIMENSIONAL PHARMACEUTICALS, INC. 2003-02-11 US disclosed
US-20010037039-A1 Aminoguanidines and alkoxyguanidines as protease inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2001-11-01 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-20010037039-A1 Aminoguanidines and alkoxyguanidines as protease inhibitors F9, PLG, MMP9 F2 32/4885MMP1 21/4885MMP9 3/4885

“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.