SCHEMBL6067652

SCHEMBL6067652

CCCCCC(C)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
MAPT P10636 1/20 0.54
ATM Q13315 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CYP4F2 P78329 3/20 0.52
CYP4A11 Q02928 3/20 0.52
THRB P10828 1/20 0.47
PKM P14618 1/20 0.47
HTT P42858 1/20 0.46
MMP8 P22894 2/20 0.44
GGPS1 O95749 1/20 0.41
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
CES2 O00748 1/20 0.38
AMPD3 Q01432 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL14502372 0.98 MEN1 (0.57) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL7508348 0.98 MEN1 (0.57) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL7510917 0.98 MEN1 (0.57) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL10631549 0.98 MEN1 (0.57) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL25189076 0.98 MEN1 (0.57) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL7508728 0.94 CYP4F2 (0.48) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL10001105 0.90 MEN1 (0.54) MEN1KMT2AMAPTATML3MBTL1
Malonic Acid SCHEMBL8372738 0.89 MEN1 (0.54) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL10031336 0.86 CYP4F2 (0.70) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL3145666 0.85 MMP8 (0.48) MEN1KMT2AMAPTATML3MBTL1

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-20110257434-A1 PERTURBED MEMBRANE-BINDING COMPOUNDS AND METHODS OF USING THE SAME APOSENSE LTD. (IL) 2011-10-20 US disclosed
WO-2006100606-A2 PREPARATION OF BETA-AMINO ACID PRECURSORS VIA INDIUM (III) MEDIATED MARKOVNIKOV ADDITION AND KNOEVENAGEL CONDENSATION WARNER-LAMBERT COMPANY LLC (US) 2006-09-28 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-20110257434-A1 PERTURBED MEMBRANE-BINDING COMPOUNDS AND METHODS OF USING THE SAME ANXA5, SELPLG, ANXA6 MEN1 1808/4885KMT2A 4743/4885MAPT 3913/4885

“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.