SCHEMBL14964308

SCHEMBL14964308

N#CCc1nonc1C(=N)N(O)c1ccc(F)c(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.33
TDO2 P48775 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL14964338 0.86 IDO1 (0.35) IDO1TDO2ALDH1A1
SCHEMBL14964328 0.85 IDO1 (0.37) IDO1TDO2ALDH1A1
SCHEMBL14964196 0.81 IDO1 (0.32) IDO1TDO2ALDH1A1
SCHEMBL15093027 0.81 MAPT (0.36) IDO1TDO2ALDH1A1
SCHEMBL4979731 0.80 IDO1 (0.34) IDO1TDO2ALDH1A1
SCHEMBL14964285 0.79 ALDH1A1 (0.32) IDO1TDO2ALDH1A1
SCHEMBL14964283 0.79 ALDH1A1 (0.32) IDO1TDO2ALDH1A1
SCHEMBL4972930 0.79 IDO1 (0.31) IDO1TDO2
SCHEMBL6046626 0.79 IDO1 (0.49) IDO1TDO2ALDH1A1
SCHEMBL14462355 0.79 MEN1 (0.41) IDO1ALDH1A1

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