SCHEMBL17665351

SCHEMBL17665351

c1ccc2c(c1)C(Oc1ccncc1)c1cncn1-2

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 1/20 0.48
IDO1 P14902 1/20 0.40
LMNA P02545 1/20 0.31
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL17651987 0.91 TDO2 (0.50) TDO2IDO1
SCHEMBL17665352 0.87 TDO2 (0.47) TDO2IDO1
SCHEMBL17651977 0.86 TDO2 (0.46) TDO2IDO1LMNA
SCHEMBL17651935 0.86 TDO2 (0.46) TDO2IDO1
SCHEMBL17652000 0.86 TDO2 (0.46) TDO2IDO1CYP19A1CYP11B2
SCHEMBL17651995 0.86 TDO2 (0.46) TDO2IDO1CYP11B2
SCHEMBL17665348 0.82 IKBKB (0.45) TDO2IDO1CYP17A1
SCHEMBL17665353 0.82 TDO2 (0.45) TDO2IDO1
SCHEMBL17665357 0.81 TDO2 (0.46) TDO2IDO1
SCHEMBL17665475 0.80 TDO2 (0.43) TDO2IDO1

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