SCHEMBL14964211

SCHEMBL14964211

N#C/N=C(/NCCO)NCc1nonc1C(=N)N(O)c1ccc(F)c(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 6/20 0.33
TDO2 P48775 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
SCHEMBL14964209 1.00 IDO1 (0.33) IDO1TDO2
Trifluoroacetic Acid SCHEMBL15092994 0.94 IDO1 (0.33) IDO1
SCHEMBL16435132 0.91 MCHR1 (0.33) IDO1
SCHEMBL14964323 0.91 IDO1 (0.32) IDO1TDO2
SCHEMBL14964216 0.90 MAPT (0.37) IDO1
SCHEMBL14964217 0.90 MAPT (0.37) IDO1
SCHEMBL4972930 0.90 IDO1 (0.31) IDO1TDO2
SCHEMBL14964229 0.87 USP2 (0.34) IDO1
SCHEMBL14964231 0.87 USP2 (0.34) IDO1
SCHEMBL16435032 0.87 IDO1 (0.33) IDO1

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
US-8450351-B2 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION (US) 2013-05-28 US claimed