SCHEMBL9007956

SCHEMBL9007956

CC(N=Nc1nc2ccccc2s1)=NNc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.73
MAPK1 P28482 4/20 0.73
TDP1 Q9NUW8 1/20 0.73
RAB9A P51151 11/20 0.47
NPC1 O15118 10/20 0.47
CASP3 P42574 3/20 0.47
SENP7 Q9BQF6 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
INSR P06213 2/20 0.45
KMT2A Q03164 8/20 0.43
SMN1; SMN2 Q16637 8/20 0.43
MEN1 O00255 7/20 0.43
SENP6 Q9GZR1 2/20 0.43
SENP8 Q96LD8 1/20 0.43
HSP90AA1 P07900 2/20 0.43
NFKB1 P19838 4/20 0.42
NFKB2 Q00653 4/20 0.42
RELA Q04206 4/20 0.42
HPGD P15428 2/20 0.42
TP53 P04637 2/20 0.42

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
SCHEMBL11327606 0.83 MAPT (0.52) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL11332706 0.83 MAPT (0.52) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL11316600 0.81 MAPT (0.51) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL11316594 0.81 MAPT (0.51) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL8767775 0.80 NPC1 (0.54) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL9007939 0.77 HSP90AA1 (0.57) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL9007943 0.77 HSP90AA1 (0.57) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL11514759 0.75 MAPT (0.46) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL11514766 0.75 MAPT (0.46) MAPTMAPK1TDP1RAB9ANPC1
SCHEMBL31314986 0.74 INSR (0.65) MAPTMAPK1TDP1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0476457-B1 2-Benzothiazolyl tetrazolium salt indicators BAYER AG (US) 1996-12-04 EP disclosed
EP-0476454-B1 Analytical method using tetrazolium salt indicators having a reflectance plateau BAYER AG (US) 1996-10-23 EP disclosed
US-5300637-A Useful in determination of reducing substances MILES INC. (US) 1994-04-05 US disclosed
US-5126275-A Chromogenic reducing indicators for reducing substances such as NADH MILES INC. (US) 1992-06-30 US disclosed
EP-0476454-A1 Analytical method using tetrazolium salt indicators having a reflectance plateau Bayer Corporation (US) 1992-03-25 EP disclosed
EP-0476457-A2 2-Benzothiazolyl tetrazolium salt indicators Bayer Corporation (US) 1992-03-25 EP disclosed