SCHEMBL17298987

SCHEMBL17298987

CC(C)(C)Oc1ccc(C(=O)Oc2ccc(Cc3ccc(OC(=O)Oc4ccc(C5(c6ccc(OC(=O)Oc7ccc(C(C)(C)C)cc7)cc6)CCCCC5)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.47
▸ MAPT P10636 4/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ PRSS1 P07477 1/20 0.41
▸ ACR P10323 1/20 0.41
▸ EPHX2 P34913 2/20 0.40
▸ NR1H4 Q96RI1 2/20 0.40
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ SLC6A2 P23975 2/20 0.36
▸ SLC6A4 P31645 2/20 0.36
▸ SLC6A3 Q01959 2/20 0.36
▸ NR4A2 P43354 1/20 0.36

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
SCHEMBL19998369 0.89 ADORA3 (0.49) ADORA3MAPTL3MBTL1TDP1EPHX2
SCHEMBL17792236 0.83 MAPT (0.65) ADORA3MAPTL3MBTL1TDP1PRSS1
SCHEMBL17298988 0.82 ADORA3 (0.52) ADORA3MAPTL3MBTL1TDP1PRSS1
SCHEMBL15887447 0.80 MAPT (0.45) ADORA3MAPTL3MBTL1TDP1PRSS1
SCHEMBL12015967 0.80 ADORA3 (0.55) ADORA3MAPTL3MBTL1TDP1EPHX2
SCHEMBL10249583 0.78 ADORA3 (0.49) ADORA3MAPTL3MBTL1TDP1PRSS1
SCHEMBL16775316 0.77 ADORA3 (0.48) ADORA3MAPTL3MBTL1TDP1MEN1
SCHEMBL14357625 0.77 ADORA3 (0.48) ADORA3MAPTL3MBTL1TDP1MEN1
SCHEMBL12242734 0.77 ELANE (0.49) ADORA3MAPTL3MBTL1TDP1PRSS1
SCHEMBL12199955 0.77 ADORA3 (0.53) ADORA3MAPTTDP1PRSS1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9665019-B2 Electrophotographic photoconductor, production method thereof, and electrophotographic apparatus FUJI ELECTRIC CO., LTD. (JP) 2017-05-30 — — US disclosed
US-20150346614-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR, PRODUCTION METHOD THEREOF, AND ELECTROPHOTOGRAPHIC APPARATUS FUJI ELECTRIC CO., LTD. (JP) 2015-12-03 — — US disclosed
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