Aspartocin

Aspartocin

SCHEMBL193132

CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=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 SCHEMBL2398841 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 1453 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10377779-B2 Carbonate prodrugs and methods of using the same ACORDA THERAPEUTICS, INC. (US) 2019-08-13 — — US claimed
US-20180086778-A1 CARBONATE PRODRUGS AND METHODS OF USING THE SAME NEUROGESX, INC. 2018-03-29 — — US claimed
CN-106821987-A A kind of liposome and preparation method and application for carrying phenolic hydroxy group insoluble drug 四川大学 2017-06-13 — — CN claimed
US-20160158261-A1 Antibiotic Kit and Composition and Uses Thereof FOAMIX LTD. (IL) 2016-06-09 — — US claimed
US-9211259-B2 Antibiotic kit and composition and uses thereof FOAMIX PHARMACEUTICALS LTD. (IL) 2015-12-15 — — US claimed
US-9016221-B2 Surface topographies for non-toxic bioadhesion control UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-04-28 — — US claimed
WO-2013187954-A1 MAGNETIC LABELING OF BACTERIA THE GENERAL HOSPITAL CORPORATION (US) 2013-12-19 — — WO claimed
US-20130252945-A1 AMORPHOUS BIOINORGANIC IONIC LIQUID COMPOSITIONS COMPRISING PHARMACEUTICALS LOS ALAMOS NAT SECURITY LLC (US) 2013-09-26 — — US claimed
US-8268352-B2 Modified release composition for highly soluble drugs TORRENT PHARMACEUTICALS LIMITED (IN) 2012-09-18 — — US claimed
US-8263125-B2 Dosage form for high dose-high solubility active ingredients that provides for immediate release and modified release of the active ingredients TORRENT PHARMACEUTICALS LIMITED (IN) 2012-09-11 — — US claimed
WO-2004004658-A2 METHODS AND COMPOSITIONS RELATING TO ISOLEUCINE BOROPROLINE COMPOUNDS POINT THERAPEUTICS, INC. (US) 2004-01-15 — — WO claimed
EP-1355920-A1 EXTRACTIVE PURIFICATION OF LIPOPEPTIDE ANTIBIOTICS Micrologix Biotech, Inc. (CA) 2003-10-29 — — EP claimed
US-20030125528-A1 Process for preparing schiff base adducts of amines with o-hydroxy aldehydes and compositions of matter based thereon HAY BRUCE A (US) 2003-07-03 — — US claimed
EP-1311281-A1 ANTIMICROBIAL SULFONAMIDE DERIVATIVES OF LIPOPEPTIDE ANTIBIOTICS Micrologix Biotech, Inc. (CA) 2003-05-21 — — EP claimed
EP-0524906-B1 DNA coding for prolylendopeptidase and use thereof NOVARTIS AG (CH) 2003-04-16 — — EP claimed
US-20020132762-A1 Extractive purification of lipopeptide antibiotics BIOSOURCE PHARM, INC. 2002-09-19 — — US claimed
WO-2002055537-A1 EXTRACTIVE PURIFICATION OF LIPOPEPTIDE ANTIBIOTICS INTRABIOTICS PHARMACEUTICALS, INC. (US) 2002-07-18 — — WO claimed
US-20020028771-A1 Antimicrobial sulfonamide derivatives of lipopeptide antibiotics BIOSOURCE PHARM, INC. 2002-03-07 — — US claimed
WO-2002005837-A1 ANTIMICROBIAL SULFONAMIDE DERIVATIVES OF LIPOPEPTIDE ANTIBIOTICS INTRABIOTICS PHARMACEUTICALS, INC. (US) 2002-01-24 — — WO claimed
CN-1305490-A Improved processing for preparing schift base adducts of amines with i(o)-hydroxy aldehydes and compositions of matter based thereon PFIZER PROD INC (US) 2001-07-25 — — CN claimed

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-20030125528-A1 Process for preparing schiff base adducts of amines with o-hydroxy aldehydes and compositions of matter based thereon OGDH, ALDH7A1, AOX1 OXTR 3362/4885AVPR1A 1970/4885AVPR1B 1040/4885
US-20020028771-A1 Antimicrobial sulfonamide derivatives of lipopeptide antibiotics STS, CUTA, LSS OXTR 3032/4885AVPR1A 3216/4885AVPR1B 4051/4885
US-10377779-B2 Carbonate prodrugs and methods of using the same CA6, CA7, CA4 OXTR 1449/4885AVPR1A 663/4885AVPR1B 647/4885
US-20130252945-A1 AMORPHOUS BIOINORGANIC IONIC LIQUID COMPOSITIONS COMPRISING PHARMACEUTICALS MCOLN1, PYM1, MCOLN2 OXTR 1736/4885AVPR1A 854/4885AVPR1B 1093/4885
US-20180086778-A1 CARBONATE PRODRUGS AND METHODS OF USING THE SAME CA6, CA7, CA4 OXTR 1449/4885AVPR1A 663/4885AVPR1B 647/4885
US-20160158261-A1 Antibiotic Kit and Composition and Uses Thereof KIT, RAB5IF, CUTA OXTR 164/4885AVPR1A 1782/4885AVPR1B 2067/4885

“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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