SCHEMBL14964205

SCHEMBL14964205

Cn1cnc(S(=O)(=O)NCc2nonc2C(=N)N(O)c2ccc(F)c(Cl)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.37
FBP1 P09467 1/20 0.36
KAT5 Q92993 1/20 0.35
KAT8 Q9H7Z6 1/20 0.35
SLC6A9 P48067 7/20 0.34
SCN9A Q15858 1/20 0.33
KCNH2 Q12809 2/20 0.33

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
SCHEMBL14964242 0.88 ALDH1A1 (0.32) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL15100371 0.85 LMNA (0.41) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL4971385 0.82 ALDH1A1 (0.38) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL14964354 0.82 ALDH1A1 (0.39) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL14964311 0.81 PROKR1 (0.37) GAALMNAKMT2AMEN1
SCHEMBL5630196 0.81 LMNA (0.40) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL5630189 0.81 LMNA (0.40) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL14964369 0.81 ALDH1A1 (0.36) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL14964244 0.80 ALDH1A1 (0.36) GAAALDH1A1LMNAKMT2AMEN1
SCHEMBL14964280 0.80 MAPT (0.46) GAAALDH1A1LMNAKMT2AMEN1

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