SCHEMBL29865034

SCHEMBL29865034

CCNc1cc(Nc2ccc(F)c(Cl)c2)c2cc(C(=O)OCC)[nH]c2c1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 19/20 0.79
TDO2 P48775 19/20 0.79
ALOX15 P16050 1/20 0.43

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
SCHEMBL28844623 1.00 IDO1 (0.79) IDO1TDO2ALOX15
SCHEMBL29865146 0.90 IDO1 (0.64) IDO1TDO2ALOX15
SCHEMBL28463699 0.90 IDO1 (0.64) IDO1TDO2ALOX15
SCHEMBL29865191 0.90 IDO1 (0.75) IDO1TDO2
SCHEMBL28844674 0.90 IDO1 (0.75) IDO1TDO2
SCHEMBL29865145 0.89 IDO1 (0.76) IDO1TDO2ALOX15
SCHEMBL28461275 0.89 IDO1 (0.63) IDO1TDO2ALOX15
SCHEMBL28467705 0.89 IDO1 (0.76) IDO1TDO2ALOX15
SCHEMBL28844820 0.88 IDO1 (1.00) IDO1TDO2
SCHEMBL29865460 0.88 IDO1 (1.00) IDO1TDO2

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