SCHEMBL28844784

SCHEMBL28844784

CCOC(=O)c1cc2c(Nc3ccc(F)c(OC(F)(F)F)c3)ccc(F)c2[nH]1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 17/20 0.74
TDO2 P48775 17/20 0.74
FBP1 P09467 3/20 0.41

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
SCHEMBL29864970 1.00 IDO1 (0.74) IDO1TDO2FBP1
SCHEMBL29865455 0.91 IDO1 (0.61) IDO1TDO2FBP1
SCHEMBL28844719 0.91 IDO1 (0.61) IDO1TDO2FBP1
SCHEMBL28844669 0.89 IDO1 (0.75) IDO1TDO2FBP1
SCHEMBL29865039 0.89 IDO1 (0.75) IDO1TDO2FBP1
SCHEMBL28844694 0.87 IDO1 (0.58) IDO1TDO2FBP1
SCHEMBL29865384 0.87 IDO1 (0.58) IDO1TDO2FBP1
SCHEMBL28844728 0.86 IDO1 (1.00) IDO1TDO2FBP1
SCHEMBL29865134 0.86 IDO1 (1.00) IDO1TDO2FBP1
SCHEMBL28465105 0.84 IDO1 (0.71) IDO1TDO2FBP1

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-110483366-B Indole compound and preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2022-09-16 CN disclosed