Methane

Methane

SCHEMBL4593466

C.O=C1c2ccccc2C(=O)c2c(Br)cccc21

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.55
ALDH1A1 P00352 7/20 0.55
MAPT P10636 7/20 0.55
L3MBTL1 Q9Y468 6/20 0.55
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
POLB P06746 1/20 0.55
HTT P42858 1/20 0.55
CDC25B P30305 1/20 0.52
MAPK1 P28482 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
EGFR P00533 3/20 0.50
RAB9A P51151 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
PABPC1 P11940 1/20 0.50
NSD2 O96028 1/20 0.50
LMNA P02545 1/20 0.50
MAOA P21397 6/20 0.47
ALOX12 P18054 2/20 0.47
CYP3A4 P08684 2/20 0.47

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
SCHEMBL472644 0.98 ADORA2A (0.57) ADORA2AALDH1A1MAPTL3MBTL1MEN1
Ammonia Solution, Strong SCHEMBL27798139 0.96 ADORA2A (0.55) ADORA2AALDH1A1MAPTL3MBTL1MEN1
Methylamine SCHEMBL9597386 0.92 ADORA2A (0.57) ADORA2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL6904504 0.91 MAOA (0.52) ADORA2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL5055109 0.89 MAPT (0.57) ADORA2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL29679284 0.89 PTPRC (0.57) ADORA2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL29403074 0.89 MAPT (0.57) ADORA2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL2079031 0.89 PTPRC (0.57) ADORA2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL5412322 0.89 MAPT (0.54) ADORA2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL15678555 0.86 CA1 (0.52) ADORA2AALDH1A1MAPTL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101472999-B Coloured silsesquioxanes CIBA HOLDING INC 2013-06-19 CN disclosed
EP-1948738-A1 COLOURED PARTICLES FOR ELECTROPHORETIC DISPLAYS Ciba Holding Inc. (CH) 2008-07-30 EP disclosed
WO-2007048721-A1 COLOURED PARTICLES FOR ELECTROPHORETIC DISPLAYS CIBA HOLDING INC. (CH) 2007-05-03 WO disclosed