SCHEMBL10076150

SCHEMBL10076150

CC[C@H](NS(C)(=O)=O)C(=O)N1CCN(C(=O)c2ccco2)CC1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
ALDH1A1 P00352 10/20 0.59
GLA P06280 2/20 0.56
PKM P14618 2/20 0.56
USP2 O75604 1/20 0.56
HSD17B10 Q99714 1/20 0.56
LMNA P02545 3/20 0.50
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL10076141 0.87 ALDH1A1 (0.62) POLBNPSR1ALDH1A1GLAPKM
SCHEMBL10076159 0.82 ALDH1A1 (0.52) POLBNPSR1ALDH1A1GLAPKM
SCHEMBL10076130 0.78 ALDH1A1 (0.58) POLBNPSR1ALDH1A1GLAHTT
SCHEMBL10076137 0.78 ALDH1A1 (0.66) POLBNPSR1ALDH1A1GLAHSD17B10
SCHEMBL1911513 0.76 ALDH1A1 (0.68) POLBNPSR1ALDH1A1PKMLMNA
SCHEMBL16026437 0.75 ALDH1A1 (0.83) POLBNPSR1ALDH1A1PKMHSD17B10
SCHEMBL10076145 0.73 MEN1 (0.46) ALDH1A1PKMHTTSMN1; SMN2TSHR
SCHEMBL14350981 0.73 NPSR1 (0.69) POLBNPSR1ALDH1A1GLAHTT
SCHEMBL13612640 0.73 ALDH1A1 (0.72) POLBNPSR1ALDH1A1GLAPKM
SCHEMBL13804475 0.71 ALDH1A1 (0.71) POLBNPSR1ALDH1A1HSD17B10LMNA

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 POLB 3723/4885NPSR1 2892/4885ALDH1A1 4455/4885

“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.