SCHEMBL1553985

SCHEMBL1553985

C=C(N)C(=O)O.N[C@@H](CSC[C@H](N)C(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.50
ARG2 P78540 1/20 0.50
NOS2 P35228 5/20 0.49
NOS1 P29475 3/20 0.49
NOS3 P29474 2/20 0.49
GRIK1 P39086 5/20 0.48
GRIK2 Q13002 4/20 0.48
GRM1 Q13255 2/20 0.48
GRM2 Q14416 2/20 0.48
ALOX15 P16050 2/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGS1 P23219 1/20 0.39
SLC7A11 Q9UPY5 1/20 0.39
ALDH1A1 P00352 1/20 0.38
BHMT Q93088 3/20 0.37
SLC7A5 Q01650 1/20 0.37
GRM8 O00222 1/20 0.37
GRM6 O15303 1/20 0.37

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
SCHEMBL27932283 1.00 ARG1 (0.50) ARG1ARG2NOS2NOS1NOS3
Cysteine SCHEMBL8585456 0.91 PTGS1 (0.57) ARG1ARG2NOS2NOS1NOS3
Cysteine SCHEMBL27480201 0.91 PTGS1 (0.57) ARG1ARG2NOS2NOS1NOS3
Cystine SCHEMBL1553822 0.89 GRIK1 (0.50) ARG1ARG2NOS2NOS1NOS3
Cystine SCHEMBL27397844 0.89 GRIK1 (0.50) ARG1ARG2NOS2NOS1NOS3
SCHEMBL29393779 0.86 ARG1 (0.61) ARG1ARG2NOS2NOS1NOS3
SCHEMBL36935 0.86 ARG1 (0.61) ARG1ARG2NOS2NOS1NOS3
SCHEMBL36934 0.86 ARG1 (0.61) ARG1ARG2NOS2NOS1NOS3
SCHEMBL36933 0.86 ARG1 (0.61) ARG1ARG2NOS2NOS1NOS3
SCHEMBL29378137 0.86 ARG1 (0.61) ARG1ARG2NOS2NOS1NOS3

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
EP-2988830-A2 COMPOSITION FOR STRAIGHTENING KERATIN FIBRES, COMPRISING A UREA AND/OR A UREA DERIVATIVE AND A NONIONIC, CATIONIC, AMPHOTERIC OR ANIONIC ASSOCIATIVE POLYMERIC THICKENER, PROCESS AND USE THEREOF L'Oréal (FR) 2016-03-02 EP disclosed
WO-2014174075-A2 COMPOSITION FOR STRAIGHTENING KERATIN FIBRES, COMPRISING A UREA AND/OR A UREA DERIVATIVE AND A NONIONIC, CATIONIC, AMPHOTERIC OR ANIONIC ASSOCIATIVE POLYMERIC THICKENER, PROCESS AND USE THEREOF L'OREAL (FR) 2014-10-30 WO disclosed
EP-2482792-A1 METHOD FOR PERMANENT WAVING OF THE HAIR BY MEANS OF A MERCAPTOSILOXANE, USE AND COMPOSITION L'Oréal (FR) 2012-08-08 EP disclosed
WO-2011039097-A1 METHOD FOR PERMANENT WAVING OF THE HAIR BY MEANS OF A MERCAPTOSILOXANE, USE AND COMPOSITION L'OREAL (FR) 2011-04-07 WO disclosed
EP-2029235-A1 METHOD FOR STRAIGHTENING KERATINOUS FIBERS USING HEATING MEANS AND AN AMIDE L'Oréal (FR) 2009-03-04 EP disclosed
EP-2029237-A1 METHOD FOR STRAIGHTENING KERATINOUS FIBERS USING HEATING MEANS AND AN ACID DERIVATIVE L'Oreal (FR) 2009-03-04 EP disclosed
EP-2029236-A1 METHOD FOR STRAIGHTENING KERATINOUS FIBERS USING HEATING MEANS AND AN AROMATIC COMPOUND L'Oreal (FR) 2009-03-04 EP disclosed
EP-2029095-A2 PROCESS FOR STRAIGHTENING KERATIN FIBRES WITH A HEATING MEANS AND DENATURING AGENTS L'Oréal (FR) 2009-03-04 EP disclosed
WO-2007135297-A2 PROCESS FOR STRAIGHTENING KERATIN FIBRES WITH A HEATING MEANS AND DENATURING AGENTS L'OREAL (FR) 2007-11-29 WO disclosed
WO-2007135299-A1 METHOD FOR STRAIGHTENING KERATINOUS FIBERS USING HEATING MEANS AND AN ACID DERIVATIVE L'OREAL (FR) 2007-11-29 WO disclosed
WO-2007135296-A1 METHOD FOR STRAIGHTENING KERATINOUS FIBERS USING HEATING MEANS AND AN AMIDE L'OREAL (FR) 2007-11-29 WO disclosed
WO-2007135298-A1 METHOD FOR STRAIGHTENING KERATINOUS FIBERS USING HEATING MEANS AND AN AROMATIC COMPOUND L'OREAL (FR) 2007-11-29 WO disclosed