SCHEMBL12413261

SCHEMBL12413261

CB(O)NCC1Oc2cc(C)ccc2C=C1c1ccc(OC(C)=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.39
LMNA P02545 4/20 0.36
KMT2A Q03164 3/20 0.33
HSD17B10 Q99714 2/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 2/20 0.33
GAA P10253 2/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
GAPDH P04406 1/20 0.32
MAPT P10636 1/20 0.32
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
CA2 P00918 1/20 0.31
CA5A P35218 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL12413209 0.84 LMNA (0.42) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL12413330 0.83 LMNA (0.40) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL12413207 0.81 MAOB (0.40) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL12413352 0.81 LMNA (0.39) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL12413264 0.79 LMNA (0.43) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL12413283 0.79 LMNA (0.45) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL12413215 0.79 LMNA (0.45) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL12413244 0.77 LMNA (0.41) MAOBLMNAKMT2AHSD17B10POLB
SCHEMBL2183407 0.77 CA2 (0.41) LMNAKMT2AHSD17B10POLBMEN1
SCHEMBL12413273 0.76 LMNA (0.40) MAOBLMNAKMT2AHSD17B10POLB

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-20110166142-A1 2-SUBSTITUTED ISOFLAVONOID COMPOUNDS, MEDICAMENTS AND USES NOVOGEN RESEARCH PTY LIMITED (AU) 2011-07-07 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-20110166142-A1 2-SUBSTITUTED ISOFLAVONOID COMPOUNDS, MEDICAMENTS AND USES NFE2L2, PTGS2, PTGES2 MAOB 580/4885LMNA 2234/4885KMT2A 2704/4885

“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.