SCHEMBL2231255

SCHEMBL2231255

N[C@]1(C(=O)O)CCC[C@H](C(=O)O)C1C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.45
GRM3 Q14832 6/20 0.45
GRM6 O15303 6/20 0.45
GRM8 O00222 4/20 0.45
ARG1 P05089 3/20 0.38
ARG2 P78540 2/20 0.38
GRM1 Q13255 3/20 0.37
GRM4 Q14833 6/20 0.36
CYP2C19 P33261 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
SLC6A12 P48065 1/20 0.36
SLC6A11 P48066 1/20 0.36
GRM5 P41594 4/20 0.34

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
SCHEMBL2788379 1.00 GRM2 (0.45) GRM2GRM3GRM6GRM8ARG1
SCHEMBL2231253 1.00 GRM2 (0.45) GRM2GRM3GRM6GRM8ARG1
SCHEMBL678446 1.00 GRM2 (0.45) GRM2GRM3GRM6GRM8ARG1
SCHEMBL2230041 1.00 GRM2 (0.45) GRM2GRM3GRM6GRM8ARG1
SCHEMBL13319983 0.74 GRM2 (0.53) GRM2GRM3GRM6GRM8GRM1
SCHEMBL20543419 0.74 GRM6 (0.41) GRM2GRM3GRM6GRM8ARG1
SCHEMBL15062900 0.73 ARG1 (0.42) GRM2GRM3GRM6GRM8ARG1
SCHEMBL28686657 0.73 ARG1 (0.42) GRM2GRM3GRM6GRM8ARG1
SCHEMBL8438555 0.71 GRM2 (0.40) GRM2GRM3GRM6GRM8ARG1
SCHEMBL8442848 0.71 GRM2 (0.40) GRM2GRM3GRM6GRM8ARG1

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-2011091033-A1 MODULATION OF NEUROGENESIS BY PPAR AGENTS BRAINCELLS, INC. (US) 2011-07-28 WO disclosed