SCHEMBL14068637

SCHEMBL14068637

CC(=O)N(Cc1ccccc1O)Cc1cc2cccc(C)c2[nH]c1=O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.58
KDM4E B2RXH2 9/20 0.58
HSD17B10 Q99714 9/20 0.58
KMT2A Q03164 5/20 0.57
MEN1 O00255 4/20 0.57
NPC1 O15118 1/20 0.57
DAO P14920 1/20 0.53
DDO Q99489 1/20 0.53
TSHR P16473 3/20 0.53
PKM P14618 2/20 0.53
RECQL P46063 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
USP2 O75604 1/20 0.52

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
SCHEMBL4745033 0.91 ALDH1A1 (0.61) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL14068682 0.88 HSD17B10 (0.61) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL14068803 0.87 ALDH1A1 (0.68) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL14068800 0.86 KDM4E (0.71) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL14068807 0.85 ALDH1A1 (0.54) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL14068384 0.82 KDM4E (0.59) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL16491220 0.78 HSD17B10 (0.62) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL4743064 0.77 KDM4E (0.71) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL14068797 0.75 ALDH1A1 (0.74) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL13496402 0.75 KMT2A (0.83) ALDH1A1KDM4EHSD17B10KMT2AMEN1

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-2008113006-A1 METHODS OF USING QUINOLINONE COMPOUNDS IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-09-18 WO disclosed