SCHEMBL3203673

SCHEMBL3203673

N=C(N)NCCC[C@H](N)C(=O)O[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 3/20 0.38
▸ NOS3 P29474 1/20 0.38
▸ NOS2 P35228 1/20 0.38
▸ NPY4R P50391 5/20 0.35
▸ NPY1R P25929 3/20 0.35
▸ DPP7 Q9UHL4 1/20 0.33
▸ OTC P00480 1/20 0.33
▸ NPY2R P49146 2/20 0.33
▸ NPY5R Q15761 2/20 0.33
▸ DPP8 Q6V1X1 1/20 0.33
▸ DPP9 Q86TI2 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ DDAH1 O94760 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL27681071 0.99 NOS1 (0.37) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL7776928 0.96 NOS1 (0.37) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL4598754 0.84 NOS1 (0.37) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL13396391 0.82 NOS1 (0.34) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL13396344 0.82 CA12 (0.36) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL3494760 0.82 NPY4R (0.34) NPY4RNPY1RNPY2RNPY5RALOX15
SCHEMBL13396394 0.81 CA12 (0.36) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL13396449 0.81 CA12 (0.36) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL288133 0.81 NPY4R (0.39) NOS1NOS3NOS2NPY4RNPY1R
SCHEMBL28712062 0.81 NPY4R (0.39) NOS1NOS3NOS2NPY4RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103509084-A Preparation method of argatroban WEIHAI WEITAI PHARMACEUTICAL TECHNOLOGY DEV CO LTD 2014-01-15 — — CN claimed
US-8629242-B2 Methods of inhibiting calcineurin with ApoE analogs COGNOSCI, INC. (US) 2014-01-14 — — US claimed
CN-102369210-A Antibacterial peptide AMP THERAPEUTICS GMBH & CO KG 2012-03-07 — — CN claimed
CN-101597291-B 2-aminoacyl tryptophyl-Beta-tetrahydric carboline-3-carboxylic acid carbobenzoxy as well as preparation method and application thereof UNIV CAPITAL MEDICAL 2011-09-28 — — CN claimed
CN-101597289-B 2-tryptophanyl-Beta-tetrahydric carboline-3-formyol amino-acid benzyl ester and preparation method and application thereof UNIV CAPITAL MEDICAL 2011-09-21 — — CN claimed
US-20100305024-A1 METHODS OF INHIBITING CALCINEURIN WITH APOE ANALOGS CORNERSTONE BIOSCIENCES, INC. 2010-12-02 — — US claimed
CN-101801995-A Antibacterial peptide AMP THERAPEUTICS GMBH & CO KG 2010-08-11 — — CN claimed
CN-101747410-A Aminoacyl tyrosyl tryptophan tripeptide with easing pain activity and preparation method and application thereof UNIV BEIJING 2010-06-23 — — CN claimed
EP-2190868-A2 METHODS OF INHIBITING CALCINEURIN WITH APOE ANALOGS Cognosci, Inc. (US) 2010-06-02 — — EP claimed
CN-101597291-A 2-(aminoacyl tryptophyl)-beta-tetrahydro carboline-3-benzyl carboxylate and its production and application UNIV CAPITAL MEDICAL (CN) 2009-12-09 — — CN claimed
CN-101597289-A 2-tryptophyl-beta-tetrahydro carboline-3-formyol amino-acid benzyl ester and its production and application UNIV CAPITAL MEDICAL (CN) 2009-12-09 — — CN claimed
CN-101591377-A Aminoacyl-phenylalanyl-tryptophan or derivatives thereof, its synthetic method and application UNIV CAPITAL MEDICAL (CN) 2009-12-02 — — CN claimed
WO-2009018477-A2 METHODS OF INHIBITING CALCINEURIN WITH APOE ANALOGS COGNOSCI, INC. (US) 2009-02-05 — — WO claimed
CN-100456398-C Electrolyte for driving electrolytic capacitor and electrolytic capacitor RUBYCON CORP (JP) 2009-01-28 — — CN claimed
CN-101279967-A Medicinal composition of trimethyl xanthone-4-acetic acid for treating cancer and use thereof WUHAN GRAND PHARMACEUTICAL GRO (CN) 2008-10-08 — — CN claimed
CN-1529892-A Electrolyte for driving electrolytic capacitor and electrolytic capacitor 如碧空株式会社 2004-09-15 — — CN claimed
EP-0399885-A1 Tripeptide, its process of preparation and its use RHONE-POULENC CHIMIE (FR) 1990-11-28 — — EP claimed
WO-2021033095-A1 NANOFORMULATIONS CONTAINING ENCAPSULATED OMEGA-3 FATTY ACIDS MACSWEENEY RACHELLE (CA) 2021-02-25 — — WO disclosed
WO-1984004301-A1 NEW OLIGOPEPTIDE ALDEHYDES USEFUL AS SPECIFIC INHIBITORS OF ENTEROKINASE NAT RES DEV (GB) 1984-11-08 — — WO disclosed
US-4070245-A Substrate for the quantitative determination of proteolytic enzymes PENTAPHARM A.G. (CH) 1978-01-24 — — US disclosed
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