SCHEMBL17665692

SCHEMBL17665692

OCc1ccccc1OC1c2ccccc2-n2cncc21

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 2/20 0.52
IDO1 P14902 2/20 0.41
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
ATP4A P20648 1/20 0.31
ATP4B P51164 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
SCHEMBL17665684 0.88 TDO2 (0.46) TDO2IDO1
SCHEMBL17665686 0.82 TDO2 (0.47) TDO2IDO1
SCHEMBL17651939 0.81 TDO2 (0.46) TDO2IDO1SLC6A2SLC6A4
SCHEMBL17651954 0.81 TDO2 (0.46) TDO2IDO1SLC6A2SLC6A4ATP4A
SCHEMBL17651951 0.81 TDO2 (0.46) TDO2IDO1SLC6A2SLC6A4
SCHEMBL17665688 0.78 TDO2 (0.58) TDO2IDO1
SCHEMBL17651968 0.78 TDO2 (0.43) TDO2IDO1
SCHEMBL17651963 0.77 TDO2 (0.49) TDO2IDO1
SCHEMBL17651987 0.77 TDO2 (0.50) TDO2IDO1SLC6A2
SCHEMBL17665687 0.76 TDO2 (0.40) TDO2IDO1SLC6A4

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
WO-2016051181-A1 4H-IMIDAZO[1,5-A]INDOLE DERIVATIVES AND THEIR USE AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) AND/OR TRYPTOPHAN 2,3-DIOXYGENASE (TD02) MODULATORS REDX PHARMA PLC (GB) 2016-04-07 WO disclosed