SCHEMBL28844698

SCHEMBL28844698

COc1ccc(Nc2cc(NC(C)=O)cc3[nH]c(C(=O)O)cc23)nc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 20/20 1.00
TDO2 P48775 20/20 1.00

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
SCHEMBL29864999 1.00 IDO1 (1.00) IDO1TDO2
SCHEMBL28844808 0.88 IDO1 (0.78) IDO1TDO2
SCHEMBL29865092 0.88 IDO1 (0.78) IDO1TDO2
SCHEMBL29865381 0.86 IDO1 (1.00) IDO1TDO2
SCHEMBL28844601 0.86 IDO1 (1.00) IDO1TDO2
SCHEMBL28844708 0.85 IDO1 (1.00) IDO1TDO2
SCHEMBL28844625 0.81 IDO1 (1.00) IDO1TDO2
SCHEMBL28844818 0.76 IDO1 (1.00) IDO1TDO2
SCHEMBL28844577 0.76 IDO1 (1.00) IDO1TDO2
SCHEMBL28844680 0.76 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