SCHEMBL1246845

SCHEMBL1246845

CN(C=O)CN1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
ALDH1A1 P00352 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
USP2 O75604 1/20 0.34
GLA P06280 1/20 0.34
KEAP1 Q14145 1/20 0.33
PAOX Q6QHF9 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL12553864 0.80 SMN1; SMN2 (0.54) HSD17B10SMN1; SMN2ALOX15TSHRALDH1A1
SCHEMBL6446184 0.80 GLA (0.40) KDM4EHSD17B10SMN1; SMN2ALDH1A1GLA
SCHEMBL12553863 0.78 SMN1; SMN2 (0.57) HSD17B10SMN1; SMN2ALOX15TSHRALDH1A1
SCHEMBL7395028 0.76 SMN1; SMN2 (0.46) KDM4EHSD17B10SMN1; SMN2ALOX15TSHR
SCHEMBL11250525 0.75 USP2 (0.41) KDM4EHSD17B10SMN1; SMN2ALOX15TSHR
SCHEMBL1246843 0.71 KDM4E (0.36) KDM4EHSD17B10SMN1; SMN2ALOX15TSHR
SCHEMBL18193869 0.70 USP2 (0.37) KDM4EHSD17B10SMN1; SMN2ALOX15TSHR
Dimethylformamide SCHEMBL1788685 0.69 GLA (0.42) KDM4ESMN1; SMN2TSHRALDH1A1USP2
SCHEMBL19243880 0.69 L3MBTL1 (0.47) KDM4EHSD17B10SMN1; SMN2ALOX15TSHR
SCHEMBL8896209 0.68 USP2 (0.35) KDM4EHSD17B10SMN1; SMN2ALOX15TSHR

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
WO-2011014520-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-02-03 WO claimed
US-20110143939-A1 QUINOXALIN-2-ONE DERIVATIVES, COMPOSITIONS WHICH PROTECT USEFUL PLANTS AND COMPRISE THESE DERIVATIVES, AND PROCESSES FOR THEIR PREPARATION AND THEIR USE BAYER CROPSCIENCE AG (DE) 2011-06-16 US disclosed
WO-2011014520-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-02-03 WO 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-20110143939-A1 QUINOXALIN-2-ONE DERIVATIVES, COMPOSITIONS WHICH PROTECT USEFUL PLANTS AND COMPRISE THESE DERIVATIVES, AND PROCESSES FOR THEIR PREPARATION AND THEIR USE QSOX1, PRDX2, NQO2 KDM4E 2076/4885HSD17B10 2876/4885SMN1; SMN2 3728/4885

“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.