SCHEMBL8957923

SCHEMBL8957923

C[C@@](N)(CC1CCCCC1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.51
GRM3 Q14832 1/20 0.51
ARG1 P05089 1/20 0.39
ARG2 P78540 1/20 0.39
GGT1 P19440 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALOX5 P09917 2/20 0.37
HPGD P15428 1/20 0.35
SLC1A3 P43003 2/20 0.35
SLC1A2 P43004 2/20 0.35
SLC1A1 P43005 2/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
CYP1A2 P05177 1/20 0.34
BLM P54132 1/20 0.34
LMNA P02545 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
METAP1 P53582 1/20 0.34
EPHX1 P07099 1/20 0.33

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
SCHEMBL3614328 1.00 GRM2 (0.51) GRM2GRM3ARG1ARG2GGT1
SCHEMBL3614325 1.00 GRM2 (0.51) GRM2GRM3ARG1ARG2GGT1
SCHEMBL28773150 0.98 GRM2 (0.49) GRM2GRM3ARG1ARG2GGT1
SCHEMBL1814400 0.98 GRM2 (0.49) GRM2GRM3ARG1ARG2GGT1
SCHEMBL1815679 0.94 GRM2 (0.45) GRM2GRM3ARG1ARG2GGT1
SCHEMBL27699325 0.94 GRM2 (0.45) GRM2GRM3ARG1ARG2GGT1
SCHEMBL25660659 0.90 ARG1 (0.42) GRM2GRM3ARG1ARG2GGT1
SCHEMBL8233826 0.84 GRM2 (0.44) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL24520311 0.82 ARG1 (0.38) GRM2GRM3ARG1ARG2GGT1
SCHEMBL27620522 0.82 GGT1 (0.46) GRM2GRM3ARG1ARG2GGT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5559233-A 3-/P-PHENYLBENZYL/IMIDAZOLONES AND PYRIMIDONES SANOFI (FR) 1996-09-24 US disclosed
US-5352788-A Angiotensin antagonist ELF SANOFI (FR) 1994-10-04 US disclosed
US-5270317-A N-substituted heterocyclic derivatives, their preparation and the pharmaceutical compositions in which they are present ELF SANOFI (FR) 1993-12-14 US disclosed