SCHEMBL3733353

SCHEMBL3733353

CCC(C)C[C@@H](N)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.62
SLC1A2 P43004 7/20 0.61
SLC1A1 P43005 7/20 0.61
SLC1A3 P43003 6/20 0.61
GRIK1 P39086 10/20 0.52
GRIK2 Q13002 8/20 0.52
GRIA4 P48058 3/20 0.45
GRIK3 Q13003 3/20 0.45
GRIK5 Q16478 3/20 0.45
GRIA2 P42262 2/20 0.44
GRIA1 P42261 1/20 0.44

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
SCHEMBL2172351 1.00 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL8634662 1.00 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL14302595 1.00 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL2295882 1.00 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL1512965 1.00 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
Hydrochloric Acid SCHEMBL22749240 0.98 SLC7A5 (0.60) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
Hydrochloric Acid SCHEMBL1025464 0.98 SLC7A5 (0.60) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL21578367 0.96 SLC7A5 (0.58) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL26471760 0.96 SLC7A5 (0.58) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL27984597 0.84 SLC1A1 (0.46) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230158179-A1 RADIOPHARMACEUTICAL CONJUGATE COMPOSITIONS AND USES THEREOF RAYZEBIO, INC. 2023-05-25 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-110016020-A Compound or pharmaceutically acceptable salt thereof, application and pharmaceutical composition thereof 铁木医药有限公司 2019-07-16 CN disclosed
CN-109384778-A Use of a compound or a pharmaceutically acceptable salt thereof for the manufacture of a medicament for the treatment of a disease, health condition or disorder 铁木医药有限公司 2019-02-26 CN disclosed
CN-109369635-A Compound or pharmaceutically acceptable salt thereof, application and pharmaceutical composition thereof 铁木医药有限公司 2019-02-22 CN disclosed
CN-108912111-A compounds and pharmaceutical compositions 铁木医药有限公司 2018-11-30 CN disclosed
CN-105408328-B sGC stimulators 铁木医药有限公司 2018-11-16 CN disclosed
WO-2013004716-A1 PEPTIDE BEADS UNIVERSITÄT BASEL (CH) 2013-01-10 WO disclosed
WO-2010022249-A2 MACROCYCLIC COMPOUNDS FOR INHIBITION OF TUMOR NECROSIS FACTOR ALPHA ENSEMBLE DISCOVERY CORPORATION (US) 2010-02-25 WO disclosed
US-20100029575-A1 N-Oxides of Kappa Receptor Peptides CARA THERAPEUTICS, INC. 2010-02-04 US disclosed
CN-101454338-A N-oxides of kappa opioid receptor peptides CARA THERAPEUTICS INC (US) 2009-06-10 CN disclosed
CN-101454017-A Method for elevating prolactin in mammals CARA THERAPEUTICS INC (US) 2009-06-10 CN 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 (2 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-20100029575-A1 N-Oxides of Kappa Receptor Peptides OPRD1, OPRK1, OPRM1 SLC7A5 975/4885SLC1A2 1101/4885SLC1A1 270/4885
US-20230158179-A1 RADIOPHARMACEUTICAL CONJUGATE COMPOSITIONS AND USES THEREOF PAICS, LNPEP, DNPEP SLC7A5 75/4885SLC1A2 236/4885SLC1A1 142/4885

“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.