SCHEMBL3259904

SCHEMBL3259904

NC(=O)CC1NCCOC1=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL8741574 0.77
SCHEMBL14037801 0.76 HSD17B10 (0.38) HSD17B10ALDH1A1POLBBLM
SCHEMBL12534333 0.75
SCHEMBL5967578 0.74
SCHEMBL1273762 0.73
SCHEMBL7290609 0.72
SCHEMBL9727772 0.72 GRIA2 (0.32)
SCHEMBL12534340 0.71
SCHEMBL12534338 0.70
SCHEMBL3547552 0.70 LMNA (0.50) ALDH1A1

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-2010003197-A1 MORPHOLINE DERIVATIVES USED AS ANTIFUNGAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2010-01-14 WO disclosed