Aspartocin

Aspartocin

SCHEMBL2398841

CC[C@H](C)C1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSCC(C(=O)N2CCCC2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OXTR P30559 11/20 0.94
▸ AVPR1A P37288 5/20 0.94
▸ AVPR1B P47901 4/20 0.94
▸ AVPR2 P30518 3/20 0.94

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
Aspartocin SCHEMBL29439933 1.00 OXTR (0.94) OXTRAVPR1AAVPR1BAVPR2
Aspartocin SCHEMBL193132 1.00 OXTR (0.94) OXTRAVPR1AAVPR1BAVPR2
SCHEMBL19712185 0.98 OXTR (0.90) OXTRAVPR1AAVPR1BAVPR2
SCHEMBL122621 0.98 OXTR (0.90) OXTRAVPR1AAVPR1BAVPR2
Oxytocin SCHEMBL29048 0.97 OXTR (1.00) OXTRAVPR1AAVPR1BAVPR2
Oxytocin SCHEMBL20707334 0.97 OXTR (1.00) OXTRAVPR1AAVPR1BAVPR2
SCHEMBL15512173 0.97 OXTR (0.92) OXTRAVPR1AAVPR1BAVPR2
Oxytocin SCHEMBL21527573 0.97 OXTR (1.00) OXTRAVPR1AAVPR1BAVPR2
Oxytocin SCHEMBL1173243 0.97 OXTR (1.00) OXTRAVPR1AAVPR1BAVPR2
Oxytocin SCHEMBL16373316 0.97 OXTR (1.00) OXTRAVPR1AAVPR1BAVPR2

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-20140066373-A1 TREATING DIABETES WITH OXYTOCIN OR OXYTOCIN ANALOGS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2014-03-06 — — US disclosed
US-8211439-B2 Albumin fusion proteins comprising insulin polypeptides HUMAN GENOME SCIENCES, INC. (US) 2012-07-03 — — US disclosed
US-8012464-B2 G-CSF-albumin fusion proteins HUMAN GENOME SCIENCES, INC. (US) 2011-09-06 — — US disclosed
US-7799759-B2 albumin fusion proteins. Nucleic acid molecules encoding the albumin fusion proteins of the invention are also encompassed by the invention, as are vectors containing these nucleic acids, host cells transformed with these nucleic acids vectors, and methods of making the albumin fusion proteins HUMAN GENOME SCIENCES, INC. (US) 2010-09-21 — — US disclosed
US-20090099073-A1 Albumin Fusion Proteins HUMAN GENOME SCIENCES, INC. 2009-04-16 — — US disclosed
US-20090093402-A1 Albumin Fusion Proteins HUMAN GENOME SCIENCES, INC. (US) 2009-04-09 — — US disclosed
US-20080167240-A1 comprising a wild-type erythropoietin polypeptide fused to wild-type albumin; albumin increases the serum plasma half-life of erythropoietin polypeptide; shelf life, storage stability; using nucleic acids, vectors, and/or host cells to treat anemia, bleeding disorder, chronic renal failure; gene therapy HUMAN GENOME SCIENCES, INC. (US) 2008-07-10 — — US disclosed
US-20080167238-A1 Albumin Fusion Proteins HUMAN GENOME SCIENCES, INC. (US) 2008-07-10 — — US disclosed
US-20080167239-A1 comprising a wild-type insulin polypeptide fused to wild-type albumin; albumin increases the serum plasma half-life of the insulin polypeptide; shelf life, storage stability; using nucleic acids, vectors, and/or host cells, for treating hyperglycemia, diabetes, hyperlipidemia; gene therapy HUMAN GENOME SCIENCES, INC. (US) 2008-07-10 — — US disclosed
US-20080161243-A1 Chimeric B-type natriuretic peptide (BNP) polypeptide for use in treatment and prevention of cardiovascular disorders HUMAN GENOME SCIENCES, INC. (US) 2008-07-03 — — US disclosed
US-20080153751-A1 Chimeric colony stimulating factor for use in treatment and prevention of cell proliferative, blood, inflammatory and nervous system disorders HUMAN GENOME SCIENCES, INC. (US) 2008-06-26 — — US disclosed
US-20080146503-A1 albumin fusion proteins. Nucleic acid molecules encoding the albumin fusion proteins of the invention are also encompassed by the invention, as are vectors containing these nucleic acids, host cells transformed with these nucleic acids vectors, and methods of making the albumin fusion proteins HUMAN GENOME SCIENCES, INC. (US) 2008-06-19 — — US 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-20080146503-A1 albumin fusion proteins. Nucleic acid molecules encoding the albumin fusion proteins of the invention are also encompassed by the invention, as are vectors containing these nucleic acids, host cells transformed with these nucleic acids vectors, and methods of making the albumin fusion proteins ALB, FABP1, HDGF OXTR 3013/4885AVPR1A 3784/4885AVPR1B 4080/4885
US-20090093402-A1 Albumin Fusion Proteins ALB, FABP1, HDGF OXTR 3592/4885AVPR1A 3916/4885AVPR1B 4175/4885
US-20090099073-A1 Albumin Fusion Proteins ALB, FABP1, HDGF OXTR 3592/4885AVPR1A 3916/4885AVPR1B 4175/4885

“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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