SCHEMBL27870367

SCHEMBL27870367

Cc1ccc(N=Nc2ccc(N)c3ncccc23)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 13/20 0.76
KMT2A Q03164 13/20 0.76
MAPT P10636 10/20 0.71
TDP1 Q9NUW8 6/20 0.71
L3MBTL1 Q9Y468 6/20 0.71
HTT P42858 5/20 0.71
SMN1; SMN2 Q16637 5/20 0.71
LMNA P02545 3/20 0.71
ALDH1A1 P00352 2/20 0.71
KCNH2 Q12809 2/20 0.71
GLO1 Q04760 4/20 0.52
MAPK1 P28482 7/20 0.52
RAB9A P51151 4/20 0.52
HSP90AA1 P07900 4/20 0.52
ATM Q13315 3/20 0.52
KDM4E B2RXH2 3/20 0.52
AGTR1 P30556 2/20 0.52
OPRK1 P41145 2/20 0.52
HKDC1 Q2TB90 1/20 0.52
NPC1 O15118 5/20 0.51

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
SCHEMBL27834022 0.87 MEN1 (1.00) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL11587160 0.84 MEN1 (0.74) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL4452805 0.83 MEN1 (1.00) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL4452808 0.83 MEN1 (1.00) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL11683113 0.80 GLO1 (0.76) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL14866934 0.79 MEN1 (0.74) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL14866739 0.79 MEN1 (0.74) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL14866738 0.79 MEN1 (0.74) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL11686615 0.75 MEN1 (0.60) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL12235556 0.75 MEN1 (0.68) MEN1KMT2AMAPTTDP1L3MBTL1

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
CN-102680546-B Nickel ion electrochemical sensor and method for synthesizing electrode material chelating resin UNIV HEFEI TECHNOLOGY 2014-06-25 CN disclosed
CN-102680546-A Nickel ion electrochemical sensor and method for synthesizing electrode material chelating resin UNIV HEFEI TECHNOLOGY 2012-09-19 CN disclosed