SCHEMBL16367388

SCHEMBL16367388

CS(=O)(=O)OCC(O)C(O)Cn1cnc([N+](=O)[O-])c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.39
PKM P14618 2/20 0.39
TAAR1 Q96RJ0 1/20 0.36
MAPT P10636 3/20 0.33
HTT P42858 3/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
POLB P06746 1/20 0.33
HIF1A Q16665 1/20 0.32
LMNA P02545 2/20 0.32
BLM P54132 1/20 0.32
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL16367306 0.89 L3MBTL1 (0.40) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL16367390 0.84 L3MBTL1 (0.38) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL15607854 0.83 ALDH1A1 (0.39) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL16367313 0.81 L3MBTL1 (0.39) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL16367336 0.81 L3MBTL1 (0.38) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL15607863 0.80 L3MBTL1 (0.45) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL16367395 0.79 L3MBTL1 (0.46) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL16367317 0.79 L3MBTL1 (0.46) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL27774814 0.77 ALDH1A1 (0.43) L3MBTL1ALDH1A1PKMTAAR1MAPT
SCHEMBL16367389 0.74 ALDH1A1 (0.39) L3MBTL1ALDH1A1PKMTAAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation AUCKLAND UNISERVICES LTD (NL) 2015-01-08 US disclosed
US-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation AUCKLAND UNISERVICES LTD (NL) 2015-01-08 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-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation CBR1, CBR3, BLVRB L3MBTL1 2029/4885ALDH1A1 140/4885PKM 867/4885

“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.