SCHEMBL28773306

SCHEMBL28773306

NC(CC1C=CC(O)(F)CC1)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 5/20 0.33
GRIN3B O60391 5/20 0.33
GRIN1 Q05586 5/20 0.33
GRIN2A Q12879 5/20 0.33
GRIN2B Q13224 5/20 0.33
GRIN2C Q14957 5/20 0.33
GRIN3A Q8TCU5 5/20 0.33
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31

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
SCHEMBL5329283 0.70 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15156025 0.69 IDO1 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1614569 0.69 IDO1 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24627762 0.69 GRIN2D (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2901549 0.68 IDO1 (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31021311 0.68 GRIN2D (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29243221 0.68 GRIN2D (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24520301 0.67 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24520317 0.67 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL24520303 0.67 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
CN-114728937-A Compositions and methods for treating respiratory syncytial virus 奇达拉治疗公司 2022-07-08 CN disclosed