SCHEMBL12412502

SCHEMBL12412502

Nc1ccc(N=Nc2ccc(N=Nc3ccc4ccccc4c3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.66
MEN1 O00255 9/20 0.66
KMT2A Q03164 9/20 0.66
NPC1 O15118 9/20 0.66
HSP90AA1 P07900 3/20 0.66
MAPT P10636 5/20 0.61
PKM P14618 1/20 0.61
HTT P42858 1/20 0.61
TDP1 Q9NUW8 5/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
ALDH1A1 P00352 4/20 0.58
CYP3A4 P08684 4/20 0.58
HSD17B10 Q99714 2/20 0.58
GAA P10253 1/20 0.53
HTR3E A5X5Y0 2/20 0.52
HTR3B O95264 2/20 0.52
HTR3A P46098 2/20 0.52
HTR3D Q70Z44 2/20 0.52
HTR3C Q8WXA8 2/20 0.52

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
SCHEMBL11891993 1.00 RAB9A (0.66) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL14280920 1.00 RAB9A (0.66) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL10017620 0.87 MEN1 (0.75) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL3283287 0.87 MEN1 (0.75) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL2291265 0.85 MEN1 (0.73) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL10349716 0.85 MEN1 (0.73) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL13591375 0.84 MEN1 (0.63) RAB9AMEN1KMT2ANPC1HSP90AA1
Betanaphthol SCHEMBL7005877 0.82 MEN1 (0.64) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL14193689 0.82 TDP1 (0.65) RAB9AMEN1KMT2ANPC1HSP90AA1
SCHEMBL12412467 0.79 NPC1 (0.66) RAB9AMEN1KMT2ANPC1HSP90AA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8477268-B2 Azo compound and salts thereof, as well as dye-based polarization films and polarizing plates comprising the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-07-02 US disclosed
US-20110164208-A1 Azo Compound And Salts Thereof, As Well As Dye-Based Polarization Films And Polarizing Plates Comprising The Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-07 US disclosed