SCHEMBL10088294

SCHEMBL10088294

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSR P00390 2/20 0.52
▸ ARG2 P78540 4/20 0.47
▸ ARG1 P05089 3/20 0.47
▸ TDP1 Q9NUW8 2/20 0.46
▸ EYA2 O00167 1/20 0.46
▸ APP P05067 1/20 0.46
▸ ACE P12821 1/20 0.46
▸ CYP1A2 P05177 3/20 0.45
▸ GRM8 O00222 1/20 0.45
▸ GRM6 O15303 1/20 0.45
▸ GRIN2D O15399 1/20 0.45
▸ GRIN3B O60391 1/20 0.45
▸ GRIK1 P39086 1/20 0.45
▸ GRM5 P41594 1/20 0.45
▸ GRIA1 P42261 1/20 0.45
▸ GRIA2 P42262 1/20 0.45
▸ GRIA3 P42263 1/20 0.45
▸ SLC1A3 P43003 1/20 0.45
▸ SLC1A2 P43004 1/20 0.45
▸ SLC1A1 P43005 1/20 0.45

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
SCHEMBL158633 0.98 GSR (0.53) GSRARG2ARG1TDP1EYA2
SCHEMBL2305699 0.98 GSR (0.53) GSRARG2ARG1TDP1EYA2
SCHEMBL7166178 0.96 GSR (0.52) GSRARG2ARG1TDP1EYA2
Water SCHEMBL1336386 0.96 GSR (0.52) GSRARG2ARG1TDP1EYA2
SCHEMBL5613110 0.95 TDP1 (0.50) GSRARG2ARG1TDP1EYA2
SCHEMBL10088295 0.92 NOS2 (0.51) GSRARG2ARG1TDP1EYA2
SCHEMBL17690553 0.90 GSR (0.46) GSRARG2ARG1TDP1EYA2
SCHEMBL13233386 0.88 GSR (0.47) GSRARG2ARG1CYP1A2GRM8
SCHEMBL11579726 0.85 GSR (0.55) GSRARG2ARG1CYP1A2GRM8
Edetic Acid SCHEMBL30301418 0.84 GSR (0.67) GSRARG2ARG1TDP1EYA2

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 9 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
US-20130012432-A1 Peptides for Treatment of Obesity NOVO NORDISK A/S (DK) 2013-01-10 — — US disclosed
US-20120021973-A1 Peptides for Treatment of Obesity NOVO NORDISK A/S (DK) 2012-01-26 — — US disclosed
US-20120021973-A1 Peptides for Treatment of Obesity NOVO NORDISK A/S (DK) 2012-01-26 — — US disclosed
WO-2011104378-A1 PEPTIDES FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2011-09-01 — — WO disclosed
WO-2011104379-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
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 GSR 2964/4885ARG2 374/4885ARG1 477/4885
US-20100173835-A1 Peptides for Treatment of Obesity MC4R, GIPR, MC3R GSR 2964/4885ARG2 374/4885ARG1 477/4885
US-20130012432-A1 Peptides for Treatment of Obesity MC4R, GIPR, MC3R GSR 2964/4885ARG2 374/4885ARG1 477/4885

“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.

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