SCHEMBL756912

SCHEMBL756912

CC(C)N[C@@H](CCN)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.52
GGT1 P19440 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
FOLH1 Q04609 5/20 0.37
NAALAD2 Q9Y3Q0 2/20 0.36
TGFBR1 P36897 1/20 0.36
GABBR2 O75899 2/20 0.35
GABBR1 Q9UBS5 2/20 0.35
GSR P00390 1/20 0.34
ACE P12821 1/20 0.34
CPB2 Q96IY4 2/20 0.33
RNPEP Q9H4A4 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
SCHEMBL8191952 1.00 GABRR1 (0.52) GABRR1GGT1ALDH1A1MEN1LMNA
SCHEMBL7027611 0.88 FOLH1 (0.46) GABRR1GGT1ALDH1A1MEN1LMNA
SCHEMBL3725106 0.88 FOLH1 (0.46) GABRR1GGT1ALDH1A1MEN1LMNA
SCHEMBL7027613 0.88 FOLH1 (0.46) GABRR1GGT1ALDH1A1MEN1LMNA
SCHEMBL209237 0.86 FOLH1 (0.53) GABRR1FOLH1GSRCPB2RNPEP
SCHEMBL1413149 0.86 FOLH1 (0.53) GABRR1FOLH1GSRCPB2RNPEP
SCHEMBL3727817 0.86 FOLH1 (0.53) GABRR1FOLH1GSRCPB2RNPEP
SCHEMBL26731701 0.83 GABRR1 (0.41) GABRR1GABBR2GABBR1
SCHEMBL757850 0.83 GABRR1 (0.41) GABRR1GABBR2GABBR1
SCHEMBL8197321 0.82 ALDH1A1 (0.41) GABRR1ALDH1A1MEN1LMNAKMT2A

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-8138361-B2 C-10 carbamates of taxanes THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-03-20 US disclosed
US-20100016238-A1 Peptides for Use in the Treatment of Obesity NOVO NORDISK A/S (DK) 2010-01-21 US disclosed
US-20100016238-A1 Peptides for Use in the Treatment of Obesity NOVO NORDISK A/S (DK) 2010-01-21 US disclosed
US-20100016237-A1 Novel Peptides for Use in the Treatment of Obesity NOVO NORDISK A/S (DK) 2010-01-21 US disclosed
US-20090306014-A1 C-10 CARBAMATES OF TAXANES ACIDOPHIL LLC (US) 2009-12-10 US disclosed
WO-2008087187-A1 PEPTIDES FOR USE IN THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2008-07-24 WO disclosed
WO-2008087186-A2 PEPTIDES FOR USE IN THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2008-07-24 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-20100016238-A1 Peptides for Use in the Treatment of Obesity MC4R, GIPR, MC3R GABRR1 686/4885GGT1 3167/4885ALDH1A1 4095/4885
US-20100016237-A1 Novel Peptides for Use in the Treatment of Obesity MC4R, MC3R, GIPR GABRR1 693/4885GGT1 3089/4885ALDH1A1 3915/4885
US-20090306014-A1 C-10 CARBAMATES OF TAXANES CASP10, S100A10, ATXN10 GABRR1 3968/4885GGT1 2506/4885ALDH1A1 1408/4885

“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.