SCHEMBL16984013

SCHEMBL16984013

CCCC(C)(C)OC(=O)c1cccc(C(=O)Oc2ccc(C3(c4ccc(C(C)(C)C)cc4)CCCC(C)CCC3)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ OPRK1 P41145 3/20 0.36
▸ OPRD1 P41143 2/20 0.36
▸ OPRM1 P35372 2/20 0.36
▸ ADORA3 P0DMS8 1/20 0.35
▸ PRSS1 P07477 1/20 0.33
▸ ACR P10323 1/20 0.33
▸ SRD5A1 P18405 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.32
▸ HRH3 Q9Y5N1 2/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL19414451 0.94 OPRD1 (0.35) MAPTTDP1L3MBTL1ALDH1A1THRB
SCHEMBL19414452 0.89 CNR2 (0.37) MAPTTDP1L3MBTL1OPRK1OPRD1
SCHEMBL16984012 0.82 MAPT (0.46) MAPTTDP1L3MBTL1ALDH1A1THRB
SCHEMBL19414450 0.78 TDP1 (0.48) MAPTTDP1L3MBTL1ALDH1A1KMT2A
SCHEMBL16984010 0.76 ADORA3 (0.43) MAPTTDP1L3MBTL1ADORA3HRH3
SCHEMBL16979802 0.75 KMT2A (0.43) MAPTTDP1ALDH1A1KMT2APRSS1
SCHEMBL14817452 0.75 ADORA3 (0.47) MAPTTDP1L3MBTL1MEN1KMT2A
SCHEMBL16983805 0.75 ESR1 (0.37) MAPTTDP1L3MBTL1ALDH1A1THRB
SCHEMBL12352776 0.75 ADORA3 (0.46) MAPTTDP1L3MBTL1MEN1KMT2A
SCHEMBL12352822 0.74 ADORA3 (0.55) MAPTTDP1L3MBTL1ALDH1A1MEN1

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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