SCHEMBL28147756

SCHEMBL28147756

CN([SiH2]c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
CA12 O43570 3/20 0.37
CA9 Q16790 3/20 0.37
CA2 P00918 2/20 0.37
FAAH O00519 1/20 0.37
PHGDH O43175 1/20 0.37
MGLL Q99685 1/20 0.37
CA1 P00915 1/20 0.37
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
RELA Q04206 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL3133237 0.78 MEN1 (0.46) MEN1HTTKMT2ACA12CA9
SCHEMBL8510220 0.76 MEN1 (0.44) MEN1HTTKMT2ACA12CA9
SCHEMBL29506827 0.75 TSHR (0.38) MEN1HTTKMT2AMGLLLMNA
SCHEMBL2267545 0.75 TSHR (0.38) MEN1HTTKMT2AMGLLLMNA
SCHEMBL14802977 0.74 MEN1 (0.42) MEN1HTTKMT2ACA12CA9
SCHEMBL16405945 0.74 MEN1 (0.42) MEN1HTTKMT2ACA12CA9
SCHEMBL3893346 0.72 ALDH1A1 (0.36) MEN1HTTKMT2ACA12CA9
SCHEMBL16582959 0.72 KMT2A (0.41) MEN1HTTKMT2ACA12CA9
SCHEMBL17045993 0.69 ALDH1A1 (0.36) MEN1HTTKMT2ACA12CA9
SCHEMBL17045985 0.69 TSHR (0.42) MEN1HTTKMT2AL3MBTL1ALDH1A1

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
CN-106674020-A Method for preparing N-methylamine from amine, formic acid and silane 南开大学 2017-05-17 CN disclosed