SCHEMBL1786014

SCHEMBL1786014

COc1cc(O)ccc1N=C1C=C(Br)C(=O)C(Br)=C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.41
ESR1 P03372 3/20 0.39
ESR2 Q92731 3/20 0.39
ALOX5 P09917 2/20 0.36
PTGS2 P35354 2/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
CYP3A4 P08684 1/20 0.36
CES2 O00748 1/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
APP P05067 1/20 0.35
KDM5A P29375 1/20 0.35
MAOA P21397 2/20 0.34
BACE1 P56817 1/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL145388 0.71 MAOB (0.55) MAOBESR1ESR2ALOX5PTGS2
SCHEMBL1786026 0.70 GLB1 (0.41) ESR1ESR2ALDH1A1TDP1KMT2A
SCHEMBL28557570 0.68 MAOB (0.55) MAOBESR1ESR2ALOX5PTGS2
SCHEMBL14364245 0.67 MAOB (0.50) MAOBESR1ESR2ALOX5PTGS2
SCHEMBL167137 0.65 MAOB (0.61) MAOBESR1ESR2ALOX5PTGS2
SCHEMBL7607683 0.64 MAOB (0.55) MAOBESR1ESR2ALOX5PTGS2
SCHEMBL119396 0.62 MAOB (0.70) MAOBESR1ESR2PTGS2ALDH1A1
SCHEMBL30514387 0.62 MAOB (0.70) MAOBESR1ESR2PTGS2ALDH1A1
SCHEMBL11146552 0.62 MEN1 (0.55) MAOBALDH1A1KMT2AMEN1NPC1
SCHEMBL1780263 0.62 HSD17B10 (0.39) MAOBESR1ESR2KMT2AMEN1

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
US-20140024102-A1 MICROBIAL FUEL CELL, FUEL AND MICROBES FOR SAID FUEL CELL, BIOREACTOR AND BIOSENSOR SONY CORPORATION 2014-01-23 US disclosed
US-8338039-B2 Fuel cell SONY CORPORATION (JP) 2012-12-25 US disclosed
US-20110287312-A1 BIOFUEL CELL SONY CORPORATION (JP) 2011-11-24 US disclosed
US-20110250511-A1 BIOFUEL CELL SONY CORPORATION (JP) 2011-10-13 US disclosed
US-20110143223-A1 FUEL CELL SONY CORPORATION (JP) 2011-06-16 US disclosed
US-20110117453-A1 FUEL REFORMER AND POWER GENERATION APPARATUS USING THE SAME SONY CORPORATION (JP) 2011-05-19 US disclosed