SCHEMBL3889602

SCHEMBL3889602

Clc1ccc(C(N=Nc2ccccc2)=NNc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.63
RAB9A P51151 6/20 0.63
NPC1 O15118 4/20 0.63
ALDH1A1 P00352 7/20 0.49
GAA P10253 6/20 0.49
LMNA P02545 3/20 0.49
MAPT P10636 10/20 0.47
TDP1 Q9NUW8 6/20 0.47
HTT P42858 5/20 0.47
MAPK1 P28482 5/20 0.47
KDM4E B2RXH2 3/20 0.47
HSP90AA1 P07900 2/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
NPSR1 Q6W5P4 3/20 0.47
CYP1A1 P04798 1/20 0.43
TSHR P16473 1/20 0.43
CYP1B1 Q16678 1/20 0.43
ALOX12 P18054 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
SCHEMBL7514231 0.94 L3MBTL1 (0.68) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL7507720 0.94 L3MBTL1 (0.68) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL7514226 0.94 L3MBTL1 (0.68) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL491429 0.89 RAB9A (0.73) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL322062 0.89 RAB9A (0.73) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL11421646 0.87 RAB9A (0.51) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL11421648 0.87 RAB9A (0.51) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL11421650 0.87 RAB9A (0.50) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL3881493 0.86 RAB9A (0.65) L3MBTL1RAB9ANPC1ALDH1A1GAA
SCHEMBL29812424 0.81 RAB9A (0.71) L3MBTL1RAB9ANPC1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515143-B1 METHOD OF ASSAY BY OXIDATION-REDUCTION REACTION WITH FORMAZAN ARKRAY INC (JP) 2009-01-07 EP disclosed
US-7381539-B2 Method of assay by oxidation-reduction reaction with formazan ARKRAY, INC. (JP) 2008-06-03 US disclosed
US-20050202399-A1 Method of assay by oxidation-reduction reaction with formazan ARKRAY, INC. (JP) 2005-09-15 US disclosed
EP-1515143-A1 METHOD OF ASSAY BY OXIDATION-REDUCTION REACTION WITH FORMAZAN ARKRAY, Inc. (JP) 2005-03-16 EP disclosed