SCHEMBL5082612

SCHEMBL5082612

CC(C)CNC(=O)CC(N)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.54
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
SLC1A2 P43004 5/20 0.48
SLC1A3 P43003 4/20 0.48
SLC1A1 P43005 4/20 0.48
GRIK1 P39086 7/20 0.44
GRIK2 Q13002 4/20 0.43
GRIA2 P42262 2/20 0.43
GRIA4 P48058 2/20 0.43
GRIK3 Q13003 2/20 0.43
GRIK5 Q16478 2/20 0.43
GRIA1 P42261 1/20 0.43
MAPT P10636 1/20 0.42
GRM1 Q13255 1/20 0.41
GRM2 Q14416 1/20 0.41
HPGD P15428 1/20 0.40

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
SCHEMBL5082599 1.00 SLC7A5 (0.54) SLC7A5CYP2D6CYP2C19SLC1A2SLC1A3
SCHEMBL27734500 0.84 CYP2D6 (0.45) SLC7A5CYP2D6CYP2C19MAPTHPGD
SCHEMBL14381150 0.84 CYP2D6 (0.45) SLC7A5CYP2D6CYP2C19MAPTHPGD
SCHEMBL25407409 0.84 SLC7A5 (0.48) SLC7A5CYP2D6CYP2C19SLC1A2SLC1A3
SCHEMBL8231097 0.84 SLC7A5 (0.48) SLC7A5CYP2D6CYP2C19SLC1A2SLC1A3
SCHEMBL1768706 0.81 SLC1A1 (0.50) SLC7A5CYP2D6CYP2C19SLC1A2SLC1A3
SCHEMBL1768701 0.81 SLC1A1 (0.50) SLC7A5CYP2D6CYP2C19SLC1A2SLC1A3
SCHEMBL1768507 0.80 GFPT1 (0.46) SLC7A5SLC1A2SLC1A3SLC1A1GRIK1
SCHEMBL28095721 0.80 GFPT1 (0.46) SLC7A5SLC1A2SLC1A3SLC1A1GRIK1
SCHEMBL402417 0.79 GRIK1 (0.47) SLC7A5SLC1A2SLC1A3SLC1A1GRIK1

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101400699-A Human glucagon-like-peptide-1 modulators and their use in the treatment of diabetes and related conditions BRISTOL MYERS SQUIBB CO (US) 2009-04-01 CN claimed
EP-1976873-A2 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS Brystol-Myers Squibb Company (US) 2008-10-08 EP claimed
US-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-10-11 US claimed
WO-2007082264-A2 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-19 WO claimed
EP-3169403-B9 ORAL PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY BOWEL DISEASES PROTAGONIST THERAPEUTICS INC (US) 2024-07-03 EP disclosed
US-12018057-B2 Peptide inhibitors of interleukin-23 receptor and their use to treat inflammatory diseases JANSSEN BIOTECH, INC. (US) 2024-06-25 US disclosed
US-12018057-B2 Peptide inhibitors of interleukin-23 receptor and their use to treat inflammatory diseases JANSSEN BIOTECH, INC. (US) 2024-06-25 US disclosed
US-20230203100-A1 COMPOSITIONS INCLUDING MULTI-AGONIST PEPTIDES AND METHODS OF MANUFACTURE AND USE PEP2TANGO THERAPEUTICS INC. 2023-06-29 US disclosed
US-20230203100-A1 COMPOSITIONS INCLUDING MULTI-AGONIST PEPTIDES AND METHODS OF MANUFACTURE AND USE PEP2TANGO THERAPEUTICS INC. 2023-06-29 US disclosed
US-20230129095-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY DISEASES PROTAGONIST THERAPEUTICS, INC. (US) 2023-04-27 US disclosed
US-20230129095-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY DISEASES PROTAGONIST THERAPEUTICS, INC. (US) 2023-04-27 US disclosed
WO-2023288313-A1 COMPOSITIONS INCLUDING MULTI-AGONIST PEPTIDES AND METHODS OF MANUFACTURE AND USE PEP2TANGO THERAPEUTICS INC. (US) 2023-01-19 WO disclosed
US-9624268-B2 Oral peptide inhibitors of interleukin-23 receptor and their use to treat inflammatory bowel diseases PROTAGONIST THERAPEUTICS, INC. (US) 2017-04-18 US disclosed
WO-2017011820-A2 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY DISEASES PROTAGONIST THERAPEUTICS, INC. (US) 2017-01-19 WO disclosed
US-20160145306-A1 ORAL PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY BOWEL DISEASES PROTAGONIST THERAPEUTICS, INC. 2016-05-26 US disclosed
US-20160145306-A1 ORAL PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY BOWEL DISEASES PROTAGONIST THERAPEUTICS, INC. 2016-05-26 US disclosed
WO-2016011208-A1 ORAL PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY BOWEL DISEASES PROTAGONIST THERAPEUTICS, INC. (US) 2016-01-21 WO disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US disclosed
EP-2948450-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals, Inc. (US) 2015-12-02 EP disclosed
WO-2014117090-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2014-07-31 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 (6 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-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS GLP1R, GIPR, IAPP SLC7A5 2674/4885CYP2D6 2043/4885CYP2C19 2118/4885
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO SLC7A5 2234/4885CYP2D6 543/4885CYP2C19 691/4885
US-20230129095-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY DISEASES IL23R, IL1RN, VIP SLC7A5 3470/4885CYP2D6 4660/4885CYP2C19 2419/4885
US-20160145306-A1 ORAL PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY BOWEL DISEASES IL23R, IL1RN, VIP SLC7A5 3283/4885CYP2D6 4259/4885CYP2C19 1244/4885
US-20230203100-A1 COMPOSITIONS INCLUDING MULTI-AGONIST PEPTIDES AND METHODS OF MANUFACTURE AND USE IAPP, GPR119, GIPR SLC7A5 1279/4885CYP2D6 4658/4885CYP2C19 4621/4885
US-12018057-B2 Peptide inhibitors of interleukin-23 receptor and their use to treat inflammatory diseases IL23R, IL1RN, VIP SLC7A5 3470/4885CYP2D6 4660/4885CYP2C19 2419/4885

“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.