SCHEMBL44691

SCHEMBL44691

CNC(=O)Cc1cnno1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.35
VHL P40337 1/20 0.35
NR4A2 P43354 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 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
SCHEMBL3854556 0.79
SCHEMBL14745845 0.76 TDP1 (0.33) TDP1
SCHEMBL44361 0.75
SCHEMBL3798748 0.70 HDAC4 (0.41) HDAC4VHL
SCHEMBL14310605 0.69 VHL (0.69) VHL
SCHEMBL17918751 0.69 CCNE1 (0.38) VHL
SCHEMBL17916146 0.66 CCNE2 (0.44) HDAC4NR4A2
SCHEMBL11833092 0.65 GAA (0.35) HDAC4NR4A2LMNA
SCHEMBL13411549 0.64 ALDH1A1 (0.49) TDP1
SCHEMBL27368805 0.64 NR4A2 (0.35) HDAC4NR4A2TDP1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011137587-A1 CYTOKINE INHIBITORS HUTCHISON MEDIPHARMA LIMITED (CN) 2011-11-10 WO claimed
WO-2011137587-A1 CYTOKINE INHIBITORS HUTCHISON MEDIPHARMA LIMITED (CN) 2011-11-10 WO disclosed