SCHEMBL10045894

SCHEMBL10045894

CC1(C)c2ccccc2-c2cccc(-c3ccc4c(c3)C(=O)c3cc(-c5cccc6c5C(C)(C)c5ccccc5-6)ccc3CC4)c21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ CES1 P23141 1/20 0.40
▸ MET P08581 1/20 0.39
▸ MAPT P10636 2/20 0.36
▸ PLIN1 O60240 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ PLIN5 Q00G26 1/20 0.36
▸ ABHD5 Q8WTS1 1/20 0.36
▸ PGR P06401 4/20 0.35
▸ RARB P10826 1/20 0.35
▸ RARG P13631 1/20 0.35
▸ RXRA P19793 1/20 0.35
▸ MAPK14 Q16539 2/20 0.34
▸ GRIA1 P42261 1/20 0.33
▸ CACNG8 Q8WXS5 1/20 0.33
▸ TDP2 O95551 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ PTPRC P08575 1/20 0.33
▸ PTPN1 P18031 1/20 0.33

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
SCHEMBL14925859 0.85 L3MBTL1 (0.46) TDP1L3MBTL1CES1METMAPT
SCHEMBL14925861 0.84 L3MBTL1 (0.43) TDP1L3MBTL1CES1METMAPT
SCHEMBL10045895 0.84 TDP1 (0.43) TDP1L3MBTL1CES1METMAPT
SCHEMBL10045919 0.84 L3MBTL1 (0.45) TDP1L3MBTL1CES1METMAPT
SCHEMBL10057962 0.84 PTPRC (0.36) TDP1L3MBTL1MAPTPLIN1ALDH1A1
SCHEMBL10057972 0.80 PDK2 (0.36) PGRRARBRARGRXRA
SCHEMBL10057539 0.80 PTPRC (0.36) L3MBTL1MAPTPGRRARBRARG
SCHEMBL3271140 0.78 PGR (0.37) TDP1ALDH1A1PGRRARBRARG
SCHEMBL12177817 0.75 MAOA (0.44) TDP1L3MBTL1MAPTALDH1A1PGR
SCHEMBL10045638 0.75 L3MBTL1 (0.54) TDP1L3MBTL1CES1METMAPT

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
US-20130112965-A1 ORGANIC LIGHT-EMITTING DEVICE MATERIAL HAVING DIBENZOSUBERONE SKELETON CANON KABUSHIKI KAISHA (JP) 2013-05-09 — — US disclosed
US-20130112965-A1 ORGANIC LIGHT-EMITTING DEVICE MATERIAL HAVING DIBENZOSUBERONE SKELETON CANON KABUSHIKI KAISHA (JP) 2013-05-09 — — US disclosed
WO-2012008558-A1 ORGANIC LIGHT-EMITTING DEVICE MATERIAL HAVING DIBENZOSUBERONE SKELETON CANON KABUSHIKI KAISHA (JP) 2012-01-19 — — WO disclosed
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