SCHEMBL10076155

SCHEMBL10076155

CC[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NC(C)C

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 5/20 0.53
MMP2 P08253 5/20 0.53
MMP9 P14780 5/20 0.53
MMP1 P03956 4/20 0.53
MMP3 P08254 4/20 0.53
MMP7 P09237 4/20 0.53
EEF2K O00418 3/20 0.48
ADAMTS4 O75173 2/20 0.46
CTSL P07711 2/20 0.45
CTSS P25774 2/20 0.45
CTSK P43235 2/20 0.45
KDM1A O60341 1/20 0.43
CYP19A1 P11511 1/20 0.43
IDO1 P14902 1/20 0.42
S1PR1 P21453 1/20 0.42
HSD11B1 P28845 2/20 0.42

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
SCHEMBL10076139 0.82 MMP2 (0.54) MMP13MMP2MMP9MMP1MMP3
SCHEMBL10076151 0.80 EEF2K (0.52) MMP13MMP2MMP9MMP1MMP3
SCHEMBL8277063 0.77 MMP13 (0.60) MMP13MMP2MMP9MMP1MMP3
SCHEMBL7374552 0.76 MMP13 (0.64) MMP13MMP2MMP9MMP1MMP3
SCHEMBL9595491 0.75 MMP13 (0.50) MMP13MMP2MMP9MMP1MMP3
SCHEMBL10076152 0.74 MEN1 (0.59) MMP13MMP2MMP9MMP1MMP3
SCHEMBL8091795 0.73 MMP2 (0.56) MMP13MMP2MMP9MMP1MMP3
SCHEMBL6323240 0.71 MMP13 (0.53) MMP13MMP2MMP9MMP1MMP3
SCHEMBL6323244 0.71 MMP13 (0.53) MMP13MMP2MMP9MMP1MMP3
SCHEMBL28690186 0.70 TDP1 (0.72) MMP13MMP2MMP9MMP1MMP3

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-8093231-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2012-01-10 US disclosed
US-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES TELIK, INC. 2008-02-14 US disclosed
US-7262182-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2007-08-28 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-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES MTAP, TYMP, PHOSPHO1 MMP13 4661/4885MMP2 4669/4885MMP9 4231/4885

“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.