SCHEMBL9543040

SCHEMBL9543040

COC(=O)[C@@H](N)Cc1ccccc1C(=O)[C@@H](N)CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
KIF11 P52732 1/20 0.38
NOS3 P29474 3/20 0.38
NOS1 P29475 3/20 0.38
NOS2 P35228 3/20 0.38
OPRK1 P41145 1/20 0.38
LTA4H P09960 5/20 0.37
ANPEP P15144 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PTGS2 P35354 1/20 0.35

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
SCHEMBL27296261 1.00 KMT2A (0.42) KMT2AKIF11NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL27327728 0.99 KMT2A (0.41) KMT2AKIF11NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL27327731 0.99 KMT2A (0.41) KMT2AKIF11NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL27317179 0.97 KMT2A (0.40) KMT2AKIF11NOS3NOS1NOS2
SCHEMBL27624203 0.88 MEN1 (0.43) KMT2ANOS3NOS1NOS2KDM4E
SCHEMBL27624205 0.88 MEN1 (0.43) KMT2ANOS3NOS1NOS2KDM4E
SCHEMBL27302283 0.87 OPRK1 (0.42) KMT2AOPRK1ANPEPALDH1A1HSD17B10
SCHEMBL8390339 0.84 CYP2C9 (0.47) KMT2AKIF11NOS3NOS1NOS2
SCHEMBL8188813 0.84 CYP2C9 (0.47) KMT2AKIF11NOS3NOS1NOS2
SCHEMBL27293020 0.84 NOS3 (0.50) KMT2ANOS3NOS1NOS2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101138391-B Feed additive and preparing method thereof HENAN GUANG AN BIOLOG TECHNOLOGY CO LTD 2011-05-04 CN claimed
CN-101138391-A Feed additive and preparing method thereof HENAN GUANG AN BIOLOG TECHNOLO (CN) 2008-03-12 CN claimed
CN-100342798-C Reinforced feed for promoting pig feed intake and its preparation method HENAN GUANG AN BIOTECHNOLOGY C (CN) 2007-10-17 CN claimed
CN-1802989-A Reinforced feed for promoting pig feed intake and its preparation method HENAN GUANG AN BIOTECHNOLOGY C (CN) 2006-07-19 CN claimed
CN-1178953-C Synthesis and recovery of aspartame involving enzymatic deformylation step 2004-12-08 CN claimed
CN-1135237-C Crystallization of alpha-L-aspartyl-L-phenylalanine methyl ester from aqueous solution 2004-01-21 CN claimed
CN-1335851-A Synthesis and recovery of aspartame involving enzymatic deformylation step HOLLAND SWEETENER CO (NL) 2002-02-13 CN claimed
CN-1036201-C Process for separating alpha-L-aspartyl-L-methyl phenylalaninate MITSUI TOATSU CHEMICALS (JP) 1997-10-22 CN claimed
CN-1143649-A Crystallization of alpha-L-aspartyl-L-phenylalanine methyl ester from aqueous solution HOLLAND SWEETENER CO (NL) 1997-02-26 CN claimed
CN-1032212-C N-protected alpha-L-aspartyl-L-methyl phenylalaninate MITSUI TOATSU CHEMICALS (JP) 1996-07-03 CN claimed
CN-1113266-A Enzymatic coupling of L-phenylalanine methyl ester and N-benzyloxycarbonyl-aspartic acid HOLLAND SWEETENER CO (NL) 1995-12-13 CN claimed
CN-1036581-A N-is protected the preparation method of 2-L-aspartyl-L-phenylalanine methyl esters MITSUI TOATSU CHEMICALS (JP) 1989-10-25 CN claimed
CN-1036580-A The separation method of 2-L-aspartyl-L-phenylalanine methyl esters MITSUI TOATSU CHEMICALS (JP) 1989-10-25 CN claimed
CN-101848655-B Acidic beverage containing aspartame SUNTORY HOLDINGS LTD 2012-09-19 CN disclosed
CN-101138391-B Feed additive and preparing method thereof HENAN GUANG AN BIOLOG TECHNOLOGY CO LTD 2011-05-04 CN disclosed
CN-101848655-A Acidic beverage containing aspartame SUNTORY LTD 2010-09-29 CN disclosed
CN-1036581-A N-is protected the preparation method of 2-L-aspartyl-L-phenylalanine methyl esters MITSUI TOATSU CHEMICALS (JP) 1989-10-25 CN disclosed
CN-1036581-A N-is protected the preparation method of 2-L-aspartyl-L-phenylalanine methyl esters MITSUI TOATSU CHEMICALS (JP) 1989-10-25 CN disclosed
CN-1036580-A The separation method of 2-L-aspartyl-L-phenylalanine methyl esters MITSUI TOATSU CHEMICALS (JP) 1989-10-25 CN disclosed
CN-1036581-A N-is protected the preparation method of 2-L-aspartyl-L-phenylalanine methyl esters MITSUI TOATSU CHEMICALS (JP) 1989-10-25 CN disclosed