SCHEMBL6265347

SCHEMBL6265347

N#Cc1ccc(-c2ccc(OC(=O)N(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
TSHR P16473 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MMP2 P08253 6/20 0.49
SCN9A Q15858 2/20 0.48
ABCB1 P08183 1/20 0.45
HPGD P15428 1/20 0.45
ABCG2 Q9UNQ0 1/20 0.45
MMP3 P08254 5/20 0.44
MMP1 P03956 1/20 0.43
MMP9 P14780 1/20 0.43
MMP13 P45452 1/20 0.43
F2 P00734 1/20 0.43
NPC1 O15118 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL5650101 0.86 RAB9A (0.59) ATMTDP1L3MBTL1NPSR1MMP2
SCHEMBL28489728 0.82 ATM (0.72) ATMTDP1L3MBTL1TSHRNPSR1
SCHEMBL20336349 0.82 L3MBTL1 (0.92) ATMTDP1L3MBTL1TSHRNPSR1
SCHEMBL7154015 0.79 L3MBTL1 (0.53) ATMTDP1L3MBTL1TSHRNPSR1
SCHEMBL867886 0.79 L3MBTL1 (1.00) ATMTDP1L3MBTL1TSHRNPSR1
SCHEMBL4420254 0.77 MMP2 (0.60) MMP2ABCB1HPGDABCG2MMP3
SCHEMBL3277145 0.77 ALDH1A1 (0.54) TDP1L3MBTL1MMP2ABCB1HPGD
SCHEMBL8917849 0.76 ALDH1A1 (0.56) TDP1L3MBTL1MMP2ABCB1HPGD
SCHEMBL21729903 0.74 L3MBTL1 (0.76) ATMTDP1L3MBTL1TSHRNPSR1
SCHEMBL14698064 0.74 KMT2A (0.54) ATMTDP1L3MBTL1TSHRNPSR1

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-2005095544-A1 LIQUID CRYSTAL COMPOUNDS, LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2005-10-13 WO disclosed