SCHEMBL8724779

SCHEMBL8724779

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 1/20 0.45
ARG1 P05089 1/20 0.41
ARG2 P78540 1/20 0.41
BLM P54132 2/20 0.39
NOS2 P35228 5/20 0.38
NOS1 P29475 3/20 0.37
ALDH1A1 P00352 5/20 0.36
MEN1 O00255 2/20 0.36
CYP1A2 P05177 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
EGFR P00533 1/20 0.36
FYN P06241 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL497269 0.83 GGT1 (0.43) GGT1ARG1ARG2BLMNOS2
SCHEMBL25660522 0.81 GGT1 (0.42) GGT1ARG1ARG2BLMNOS2
SCHEMBL181332 0.80 GGT1 (0.45) GGT1ARG1ARG2BLMNOS2
SCHEMBL160649 0.80 GGT1 (0.45) GGT1ARG1ARG2BLMNOS2
SCHEMBL160650 0.80 GGT1 (0.45) GGT1ARG1ARG2BLMNOS2
SCHEMBL5059415 0.79 GGT1 (0.41) GGT1ARG1ARG2BLMNOS2
Hydrochloric Acid SCHEMBL8995749 0.78 GGT1 (0.43) GGT1ARG1ARG2BLMNOS2
Hydrochloric Acid SCHEMBL1025465 0.78 GGT1 (0.43) GGT1ARG1ARG2BLMNOS2
Hydrochloric Acid SCHEMBL8995745 0.78 GGT1 (0.43) GGT1ARG1ARG2BLMNOS2
Hydrochloric Acid SCHEMBL5764217 0.78 GGT1 (0.43) GGT1ARG1ARG2BLMNOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885288-A1 BODY SOAP COMPOSITION Johnson & Johnson Kabushiki Kaisha (JP) 1998-12-23 EP disclosed
WO-1997027279-A1 BODY SOAP COMPOSITION JOHNSON & JOHNSON KABUSHIKI KAISHA (JP) 1997-07-31 WO disclosed