SCHEMBL6796513

SCHEMBL6796513

C[C@@H](NS(=O)(=O)c1ccc(Sc2ccccc2)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 10/20 0.50
ADAMTS4 O75173 2/20 0.49
MMP2 P08253 6/20 0.47
MMP1 P03956 3/20 0.47
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42
MMP9 P14780 4/20 0.41
MMP3 P08254 3/20 0.41
MMP7 P09237 2/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL789823 0.88 ADAMTS4 (0.54) MMP13ADAMTS4MMP2MMP1ALDH1A1
SCHEMBL6798909 0.83 ADAMTS4 (0.70) MMP13ADAMTS4MMP2MMP1ALDH1A1
SCHEMBL7897307 0.82 ADAMTS4 (0.47) MMP13ADAMTS4MMP2MMP1ALDH1A1
SCHEMBL27465878 0.80 ALDH1A1 (0.50) MMP13ADAMTS4MMP2MMP1ALDH1A1
SCHEMBL1186251 0.80 MMP2 (0.50) MMP13ADAMTS4MMP2MMP1ALDH1A1
SCHEMBL8445730 0.80 MMP2 (0.59) MMP13ADAMTS4MMP2MMP1ALDH1A1
SCHEMBL1185524 0.80 MMP2 (0.50) MMP13ADAMTS4MMP2MMP1ALDH1A1
SCHEMBL7669662 0.80 MMP9 (0.62) MMP2ALDH1A1HSD17B10L3MBTL1MMP9
SCHEMBL29540524 0.79 HSD17B10 (0.54) MMP13MMP2MMP1ALDH1A1HSD17B10
SCHEMBL6799581 0.76 TSHR (0.51) MMP13ADAMTS4MMP2MMP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040034071-A1 Thioaryl sulfonamide hydroxamic acid compounds PHARMACIA CORPORATION 2004-02-19 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-20040034071-A1 Thioaryl sulfonamide hydroxamic acid compounds MMP10, MMP1, MMP3 MMP13 11/4885ADAMTS4 21/4885MMP2 4/4885

“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.