SCHEMBL6733013

SCHEMBL6733013

CC(C)C[C@@H](NS(=O)(=O)Cc1ccc2ccccc2c1)C(=O)NO

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 6/20 0.48
MMP8 P22894 5/20 0.48
MMP2 P08253 4/20 0.48
ADAM17 P78536 4/20 0.47
MMP1 P03956 1/20 0.47
MMP13 P45452 1/20 0.47
ANPEP P15144 2/20 0.46
LARS1 Q9P2J5 1/20 0.46
ELANE P08246 1/20 0.43
CASP1 P29466 1/20 0.43
CASP3 P42574 1/20 0.43
CASP6 P55212 1/20 0.43
CASP8 Q14790 1/20 0.43

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
SCHEMBL6733017 1.00 MMP9 (0.48) MMP9MMP8MMP2ADAM17MMP1
SCHEMBL6738452 0.89 MME (0.48) MMP9MMP2MMP1MMP13LARS1
SCHEMBL6738450 0.89 MME (0.48) MMP9MMP2MMP1MMP13LARS1
SCHEMBL6739658 0.83 TSHR (0.45) MMP9MMP8MMP2ADAM17MMP1
SCHEMBL6739657 0.83 TSHR (0.45) MMP9MMP8MMP2ADAM17MMP1
SCHEMBL6741426 0.83 CTSB (0.43) MMP9MMP8MMP2ADAM17MMP1
SCHEMBL6741428 0.83 CTSB (0.43) MMP9MMP8MMP2ADAM17MMP1
SCHEMBL1770896 0.80 LARS1 (0.62) MMP9MMP2ADAM17MMP1MMP13
SCHEMBL7948476 0.80 LARS1 (0.62) MMP9MMP2ADAM17MMP1MMP13
SCHEMBL6738793 0.79 MEP1B (0.45) MMP9MMP8ADAM17MMP1MMP13

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
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates SMITHKLINE BEECHAM P.L.C. 2004-11-11 US claimed
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates SMITHKLINE BEECHAM P.L.C. 2004-11-11 US disclosed
US-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives SMITHKLINE BEECHAM P.L.C. (GB) 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 (2 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-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives CD40, CD22, CD2 MMP9 964/4885MMP8 1071/4885MMP2 689/4885
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates CD40, TNFRSF1A, CD2 MMP9 1073/4885MMP8 1161/4885MMP2 849/4885

“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.