SCHEMBL418231

SCHEMBL418231

CC(C)(C)OC(=O)CC(N)(CC(=O)OC(C)(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SYK P43405 1/20 0.43
KMT2A Q03164 2/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SLC15A1 P46059 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
LTA4H P09960 1/20 0.39

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
SCHEMBL12874139 0.97 ALDH1A1 (0.46) ALDH1A1MAPK1L3MBTL1SYKKMT2A
SCHEMBL27711717 0.86 ALDH1A1 (0.44) ALDH1A1MAPK1L3MBTL1SYKKMT2A
SCHEMBL1626512 0.86 ALDH1A1 (0.44) ALDH1A1MAPK1L3MBTL1SYKKMT2A
SCHEMBL27711718 0.86 ALDH1A1 (0.44) ALDH1A1MAPK1L3MBTL1SYKKMT2A
Ammonia Solution, Strong SCHEMBL27780858 0.85 ALDH1A1 (0.43) ALDH1A1MAPK1L3MBTL1SYKKMT2A
Ammonia Solution, Strong SCHEMBL27493617 0.85 ALDH1A1 (0.43) ALDH1A1MAPK1L3MBTL1SYKKMT2A
SCHEMBL27542759 0.84 ALDH1A1 (0.42) ALDH1A1MAPK1L3MBTL1SYKKMT2A
SCHEMBL27827638 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SYKKMT2A
SCHEMBL27696911 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1SYKKMT2A
SCHEMBL30975317 0.81 LTA4H (0.44) ALDH1A1MAPK1L3MBTL1SYKKMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130012432-A1 Peptides for Treatment of Obesity NOVO NORDISK A/S (DK) 2013-01-10 US disclosed
EP-2539364-A1 PEPTIDES FOR TREATMENT OF OBESITY Novo Nordisk A/S (DK) 2013-01-02 EP disclosed
US-20120021973-A1 Peptides for Treatment of Obesity NOVO NORDISK A/S (DK) 2012-01-26 US disclosed
EP-2370104-A1 PEPTIDES FOR TREATMENT OF OBESITY Novo Nordisk A/S (DK) 2011-10-05 EP disclosed
WO-2011104378-A1 PEPTIDES FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2011-09-01 WO disclosed
US-20100173835-A1 Peptides for Treatment of Obesity NOVO NORDISK A/S (DK) 2010-07-08 US disclosed
WO-2010060901-A1 PEPTIDES FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2010-06-03 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 (3 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-20120021973-A1 Peptides for Treatment of Obesity MC4R, GIPR, MC3R ALDH1A1 4086/4885MAPK1 1616/4885L3MBTL1 2082/4885
US-20100173835-A1 Peptides for Treatment of Obesity MC4R, GIPR, MC3R ALDH1A1 4086/4885MAPK1 1616/4885L3MBTL1 2082/4885
US-20130012432-A1 Peptides for Treatment of Obesity MC4R, GIPR, MC3R ALDH1A1 4086/4885MAPK1 1616/4885L3MBTL1 2082/4885

“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.