SCHEMBL13486540

SCHEMBL13486540

CCOC(=O)C1=C(OCc2ccccc2)C(=O)OC1C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.46
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
ESR1 P03372 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HSP90AA1 P07900 1/20 0.43
NR1H4 Q96RI1 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TRPC5 Q9UL62 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL13486530 0.80 HPSE (0.52) MAOBL3MBTL1PPARGESR1ALDH1A1
SCHEMBL9423156 0.77 LMNA (0.43) MAOBLMNAL3MBTL1PPARGALDH1A1
SCHEMBL9423154 0.77 LMNA (0.43) MAOBLMNAL3MBTL1PPARGALDH1A1
SCHEMBL14608877 0.73 MAOB (0.46) MAOBLMNAL3MBTL1PPARGKMT2A
SCHEMBL8916232 0.71 ALDH1A1 (0.46) LMNAESR1KMT2AMEN1ALDH1A1
SCHEMBL23796824 0.70 MEN1 (0.60) MAOBLMNAL3MBTL1PPARGKMT2A
SCHEMBL340618 0.70 MAOB (0.67) MAOBLMNAL3MBTL1PPARGESR1
SCHEMBL340937 0.70 HTT (0.69) L3MBTL1KMT2AMEN1HSP90AA1ALDH1A1
SCHEMBL112672 0.69 MEN1 (0.59) MAOBLMNAL3MBTL1PPARGKMT2A
SCHEMBL4400182 0.69 KMT2A (0.67) MAOBLMNAL3MBTL1PPARGKMT2A

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-20100029761-A1 NOVEL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME, AND METHODS OF USE FOR SAME FAS SECURED CREDITORS HOLDCO, LLC 2010-02-04 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-20100029761-A1 NOVEL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME, AND METHODS OF USE FOR SAME NR1H4, CYP3A4, CYP4A11 MAOB 1450/4885LMNA 3460/4885L3MBTL1 4772/4885

“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.