SCHEMBL6814546

SCHEMBL6814546

CN(O)[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.38
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.34
OTC P00480 1/20 0.33
FOLH1 Q04609 2/20 0.32
ITGB3 P05106 2/20 0.32
ITGA2B P08514 2/20 0.32
ALB P02768 1/20 0.32
DDAH1 O94760 1/20 0.31
NPY4R P50391 3/20 0.30
NPY1R P25929 2/20 0.30
NPY2R P49146 2/20 0.30
NPY5R Q15761 2/20 0.30

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
SCHEMBL995563 0.89 NOS2 (0.38) ALOX15NOS3NOS1NOS2MEN1
SCHEMBL29770073 0.89 NOS2 (0.38) ALOX15NOS3NOS1NOS2MEN1
SCHEMBL196827 0.89 NOS2 (0.38) ALOX15NOS3NOS1NOS2MEN1
SCHEMBL160690 0.89 NOS2 (0.38) ALOX15NOS3NOS1NOS2MEN1
SCHEMBL288819 0.89 NOS2 (0.38) ALOX15NOS3NOS1NOS2MEN1
Hydrochloric Acid SCHEMBL12078158 0.87 NOS3 (0.37) ALOX15NOS3NOS1NOS2MEN1
Hydrochloric Acid SCHEMBL2595285 0.87 NOS3 (0.37) ALOX15NOS3NOS1NOS2MEN1
Hydrochloric Acid SCHEMBL12078437 0.87 NOS3 (0.37) ALOX15NOS3NOS1NOS2MEN1
Hydrochloric Acid SCHEMBL2595284 0.87 NOS3 (0.37) ALOX15NOS3NOS1NOS2MEN1
SCHEMBL21879810 0.86 NOS3 (0.36) ALOX15NOS3NOS1NOS2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114624362-A Kit for detecting advanced glycosylation end products in serum and application thereof 广东省中医院(广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院) 2022-06-14 CN disclosed
EP-1082112-A4 ENDOGENOUS NITRIC OXIDE SYNTHESIS UNDER CONDITIONS OF LOW OXYGEN TENSION NITROMED INC (US) 2004-06-09 EP disclosed
EP-1082112-A1 ENDOGENOUS NITRIC OXIDE SYNTHESIS UNDER CONDITIONS OF LOW OXYGEN TENSION Nitromed, Inc. (US) 2001-03-14 EP disclosed
WO-1999062509-A1 ENDOGENOUS NITRIC OXIDE SYNTHESIS UNDER CONDITIONS OF LOW OXYGEN TENSION NITROMED, INC. (US) 1999-12-09 WO disclosed