SCHEMBL10076145

SCHEMBL10076145

CC[C@H](NS(C)(=O)=O)C(=O)N1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
AIMP2 Q13155 1/20 0.46
HTT P42858 2/20 0.44
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.40
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.39
F2 P00734 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
MMP13 P45452 1/20 0.38

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
SCHEMBL13645867 0.78 HTT (0.46) MEN1KMT2AAIMP2HTTCYP3A4
SCHEMBL10076152 0.74 MEN1 (0.59) MEN1KMT2AAIMP2ALDH1A1F2
SCHEMBL5486261 0.73 CYP3A4 (0.49) HTTCYP3A4CYP2C19GAATSHR
SCHEMBL10076150 0.73 POLB (0.60) MEN1KMT2AHTTTSHRPKM
SCHEMBL13266392 0.72 CYP2C19 (0.51) HTTCYP3A4CYP2C19GAATSHR
SCHEMBL8483742 0.71 CYP3A4 (0.50) MEN1KMT2AHTTCYP3A4CYP2C19
SCHEMBL12196226 0.71 CYP3A4 (0.50) MEN1KMT2AHTTCYP3A4CYP2C19
SCHEMBL13259745 0.71 CYP3A4 (0.63) MEN1KMT2AHTTCYP3A4CYP2C19
SCHEMBL4700991 0.71 CYP3A4 (0.63) MEN1KMT2AHTTCYP3A4CYP2C19
SCHEMBL8483745 0.71 CYP3A4 (0.50) MEN1KMT2AHTTCYP3A4CYP2C19

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 MEN1 855/4885KMT2A 1619/4885AIMP2 3145/4885

“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.