SCHEMBL7897679

SCHEMBL7897679

O=[N+]([O-])c1ccccc1COc1ccncc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.62
KMT2A Q03164 5/20 0.52
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
MEN1 O00255 3/20 0.52
ATM Q13315 1/20 0.52
SYK P43405 1/20 0.49
KDM4A O75164 1/20 0.49
ALDH1A1 P00352 5/20 0.49
HTT P42858 1/20 0.49
TSHR P16473 1/20 0.49
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
HPGD P15428 1/20 0.45
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.44
RECQL P46063 1/20 0.44
HTR1A P08908 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43

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
SCHEMBL3125878 0.87 MAOB (0.68) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL7897556 0.84 RAB9A (0.60) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL9489214 0.83 MAOB (0.72) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL6542046 0.81 MAOB (0.70) MAOBKMT2ANPC1RAB9ASYK
SCHEMBL28376698 0.81 MAOB (0.66) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL920836 0.81 MAOB (0.62) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL17368204 0.81 MAOB (0.70) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL11200911 0.81 MAOB (0.61) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL17554427 0.79 MAOB (0.63) MAOBKMT2ANPC1RAB9AMEN1
SCHEMBL8342103 0.78 KMT2A (0.54) MAOBKMT2ANPC1RAB9AMEN1

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-6183934-B1 FOE USE IN FORMATION OF PATTERN OF INSULATION FILM, PASSIVATION FILM, .ALPHA.-RAY SHIELDING FILM, OPTICAL WAVEGUIDE KABUSHIKI KAISHA TOSHIBA (JP) 2001-02-06 US disclosed