SCHEMBL16601557

SCHEMBL16601557

NOc1ccc(Nc2ccc(F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
THRB P10828 1/20 0.44
MAPK1 P28482 1/20 0.44
RECQL P46063 1/20 0.44
RAB9A P51151 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KCNH2 Q12809 2/20 0.44
SCN5A Q14524 2/20 0.44
SCN9A Q15858 2/20 0.44
NR4A1 P22736 1/20 0.42
TTBK1 Q5TCY1 1/20 0.41
TTBK2 Q6IQ55 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CA12 O43570 1/20 0.40

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
SCHEMBL1313396 0.85
Hydrochloric Acid SCHEMBL2081524 0.83 IDO1 (0.48) KDM4EMAOAMAOBCA1CA2
SCHEMBL395770 0.80 ALDH1A1 (0.50) GAAMAPTNPC1MAPK1RAB9A
SCHEMBL12443124 0.79 ALDH1A1 (0.62) GAAMAPTKDM4ENPC1THRB
SCHEMBL16601556 0.77 MAPT (0.44) GAAMAPTKDM4ENPC1THRB
SCHEMBL10116834 0.77 MAPT (0.44) GAAMAPTKDM4ENPC1THRB
SCHEMBL866356 0.77 MAPT (0.77) GAAMAPTKDM4ENPC1THRB
SCHEMBL16601551 0.77 MAPT (0.44) GAAMAPTKDM4ENPC1THRB
SCHEMBL16601560 0.77 SCN9A (0.49) GAAMAPTKDM4ENPC1THRB
SCHEMBL16601558 0.77 KCNH2 (0.48) KCNH2SCN5ASCN9ATTBK1TTBK2

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
US-8993086-B2 Recordable optical recording medium TAIYO YUDEN CO., LTD. (JP) 2015-03-31 US disclosed