SCHEMBL27568751

SCHEMBL27568751

Cc1cc(C)cc(NC(=O)Nc2ccccc2C)c1

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDX3X O00571 3/20 0.73
RAB9A P51151 7/20 0.59
NPC1 O15118 6/20 0.59
MAPT P10636 5/20 0.59
KMT2A Q03164 4/20 0.59
MEN1 O00255 3/20 0.59
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
POLB P06746 3/20 0.56
ALDH1A1 P00352 2/20 0.55
IMPDH2 P12268 1/20 0.55
HPGD P15428 1/20 0.55
TP53 P04637 2/20 0.54
GAA P10253 2/20 0.54
ALOX15 P16050 1/20 0.54
HSD17B10 Q99714 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL10192076 0.87 DDX3X (0.84) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL1275926 0.85 RAB9A (0.75) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL11918074 0.84 DDX3X (1.00) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL1659299 0.84 DDX3X (1.00) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL5852186 0.84 DDX3X (0.70) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL812756 0.84 DDX3X (0.80) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL17084261 0.83 DDX3X (0.69) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL3460449 0.81 DDX3X (0.70) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL27923493 0.81 MEN1 (0.73) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL4350926 0.81 DDX3X (0.65) DDX3XRAB9ANPC1MAPTKMT2A

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
CN-1344254-A Quinoline derivatives and quinazoline derivatives KIRIN BREWERY (JP) 2002-04-10 CN disclosed