SCHEMBL29865025

SCHEMBL29865025

Cc1cc(Nc2ccc(F)c([N+](=O)[O-])c2)c2cc(C(=O)O)[nH]c2c1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 15/20 0.70
TDO2 P48775 15/20 0.70
FBP1 P09467 5/20 0.54

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
SCHEMBL28953327 1.00 IDO1 (0.70) IDO1TDO2FBP1
SCHEMBL28844591 0.87 IDO1 (0.54) IDO1TDO2FBP1
SCHEMBL29865072 0.83 IDO1 (1.00) IDO1TDO2
SCHEMBL29865167 0.83 IDO1 (0.76) IDO1TDO2
SCHEMBL28844681 0.83 IDO1 (0.76) IDO1TDO2
SCHEMBL28455724 0.83 IDO1 (1.00) IDO1TDO2
SCHEMBL28341095 0.79 LMNA (0.43) IDO1TDO2
SCHEMBL28844894 0.77 IDO1 (0.70) IDO1TDO2FBP1
SCHEMBL29865157 0.77 IDO1 (0.70) IDO1TDO2FBP1
SCHEMBL28457731 0.73 FBP1 (0.74) 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