SCHEMBL15539708

SCHEMBL15539708

CC(C)SSCC(N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.46
NOS2 P35228 3/20 0.44
NOS1 P29475 2/20 0.44
NOS3 P29474 1/20 0.44
SLC1A3 P43003 4/20 0.42
SLC1A2 P43004 4/20 0.42
SLC1A1 P43005 3/20 0.42
ARG1 P05089 1/20 0.41
ARG2 P78540 1/20 0.41
KIF11 P52732 5/20 0.41
BHMT Q93088 2/20 0.40
BHMT2 Q9H2M3 1/20 0.40
PMP22 Q01453 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC7A11 Q9UPY5 1/20 0.39
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL11680891 1.00 SLC7A5 (0.46) SLC7A5NOS2NOS1NOS3SLC1A3
SCHEMBL16728136 0.83 NOS2 (0.33) SLC7A5NOS2NOS1NOS3
Cystine SCHEMBL28213243 0.82 SLC7A5 (0.50) SLC7A5NOS2NOS1NOS3SLC1A3
SCHEMBL24068585 0.82 SLC7A5 (0.42) SLC7A5NOS2NOS1NOS3SLC1A3
SCHEMBL160076 0.82 SLC7A5 (0.42) SLC7A5NOS2NOS1NOS3SLC1A3
SCHEMBL28326099 0.82 SLC7A5 (0.42) SLC7A5NOS2NOS1NOS3SLC1A3
Cystine SCHEMBL10225 0.81 PTGS1 (0.50) SLC7A5NOS2NOS1NOS3SLC1A3
Cystine SCHEMBL21114356 0.81 PTGS1 (0.50) SLC7A5NOS2NOS1NOS3SLC1A3
Cystine SCHEMBL10224 0.81 PTGS1 (0.50) SLC7A5NOS2NOS1NOS3SLC1A3
Cystine SCHEMBL8332360 0.81 PTGS1 (0.50) SLC7A5NOS2NOS1NOS3SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013188635-A2 NOVEL METHODS OF IDENTIFYING PROTEINS VIA N-TERMINAL TAGGING AND SELECTIVE PULL-DOWN THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-12-19 WO disclosed