SCHEMBL16367359

SCHEMBL16367359

CCC(Cn1cnc([N+](=O)[O-])c1)OC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 4/20 0.40
PKM P14618 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
SLC18A3 Q16572 1/20 0.37
MITF O75030 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
HIF1A Q16665 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL16367360 0.86 L3MBTL1 (0.43) L3MBTL1ALDH1A1PKMTAAR1MITF
SCHEMBL16367313 0.83 L3MBTL1 (0.39) L3MBTL1ALDH1A1PKMTAAR1SMN1; SMN2
SCHEMBL16367345 0.79 L3MBTL1 (0.38) L3MBTL1ALDH1A1PKMTAAR1SMN1; SMN2
SCHEMBL16367393 0.78 L3MBTL1 (0.46) L3MBTL1ALDH1A1PKMTAAR1HIF1A
SCHEMBL15607863 0.77 L3MBTL1 (0.45) L3MBTL1ALDH1A1PKMTAAR1SMN1; SMN2
SCHEMBL9873776 0.75 L3MBTL1 (0.49) L3MBTL1ALDH1A1PKMTAAR1MITF
SCHEMBL28807491 0.75 L3MBTL1 (0.48) L3MBTL1ALDH1A1PKMTAAR1SMN1; SMN2
SCHEMBL24728704 0.74 L3MBTL1 (0.47) L3MBTL1ALDH1A1PKMTAAR1SMN1; SMN2
SCHEMBL27727096 0.74 L3MBTL1 (0.48) L3MBTL1ALDH1A1PKMTAAR1SMN1; SMN2
SCHEMBL19698979 0.73 L3MBTL1 (0.59) L3MBTL1ALDH1A1PKMTAAR1MITF

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-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.