SCHEMBL14071963

SCHEMBL14071963

CN1C2=Nc3c(ccc4ccccc34)O[C@]2(C)c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.52
KDM4E B2RXH2 10/20 0.52
THRB P10828 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
ALOX12 P18054 2/20 0.52
PKM P14618 2/20 0.52
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
MAPK1 P28482 3/20 0.40
HTT P42858 5/20 0.39
ALDH1A1 P00352 5/20 0.39
LMNA P02545 5/20 0.39
HPGD P15428 3/20 0.39
GAA P10253 3/20 0.39
POLB P06746 2/20 0.39
RECQL P46063 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
NPSR1 Q6W5P4 3/20 0.33
BLM P54132 2/20 0.33

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
SCHEMBL29637641 0.71 MAPT (0.59) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL13839771 0.68 MAPT (1.00) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL80364 0.68 MAPT (1.00) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL29493002 0.68 MAPT (1.00) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL13619848 0.66 MAPT (0.73) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL9061827 0.65 MAPT (0.76) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL13809428 0.64 KDM4E (0.59) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL30175134 0.64 KDM4E (0.43) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL8680331 0.64 SMN1; SMN2 (0.45) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1
SCHEMBL12410812 0.64 MAPT (0.73) MAPTKDM4ETHRBSMN1; SMN2L3MBTL1

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-7426174-B2 Information recording medium having pair of electrodes HITACHI, LTD. (JP) 2008-09-16 US disclosed