SCHEMBL16984012

SCHEMBL16984012

CCCC(C)(C)c1ccc(C2(c3ccc(OC(=O)c4ccccc4)cc3)CCCC(C)CCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.40
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ KMT2A Q03164 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ PKM P14618 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ HRH3 Q9Y5N1 9/20 0.36
▸ PARP10 Q53GL7 1/20 0.35
▸ THRB P10828 1/20 0.35

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
SCHEMBL19414450 0.92 TDP1 (0.48) MAPTTDP1L3MBTL1ADORA3SLC6A2
SCHEMBL19414451 0.88 OPRD1 (0.35) MAPTTDP1L3MBTL1ADORA3ALDH1A1
SCHEMBL19414452 0.83 CNR2 (0.37) MAPTTDP1L3MBTL1ADORA3HRH3
SCHEMBL16983804 0.83 MAPT (0.45) MAPTTDP1L3MBTL1SLC6A2SLC6A4
SCHEMBL16984010 0.82 ADORA3 (0.43) MAPTTDP1L3MBTL1ADORA3HRH3
SCHEMBL16984013 0.82 MAPT (0.42) MAPTTDP1L3MBTL1ADORA3KMT2A
SCHEMBL13168810 0.79 ADORA3 (0.55) MAPTTDP1L3MBTL1ADORA3SLC6A2
SCHEMBL16984011 0.76 ADORA3 (0.38) MAPTTDP1L3MBTL1ADORA3
SCHEMBL17792236 0.75 MAPT (0.65) MAPTTDP1L3MBTL1ADORA3SLC6A2
SCHEMBL19414761 0.74 TDP1 (0.46) MAPTTDP1L3MBTL1KMT2AALDH1A1

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
US-20150220007-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2015-08-06 — — US disclosed
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