SCHEMBL16979798

SCHEMBL16979798

COC(=O)c1ccc(Oc2ccc(C(=O)Oc3ccc(C4(c5ccc(C)cc5)CC(C)CC(C)(C)C4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
TDP1 Q9NUW8 1/20 0.42
KMT2A Q03164 7/20 0.39
ACR P10323 4/20 0.38
PRSS1 P07477 2/20 0.38
MEN1 O00255 2/20 0.38
HGFAC Q04756 1/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 1/20 0.37
MMP13 P45452 2/20 0.37
IDH1 O75874 1/20 0.36
HIF1A Q16665 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL16979808 0.97 ESR1 (0.49) ESR1ESR2TDP1KMT2AACR
SCHEMBL16979787 0.92 TDP1 (0.40) ESR1ESR2TDP1KMT2AACR
SCHEMBL16979793 0.89 ESR1 (0.45) ESR1ESR2TDP1KMT2AACR
SCHEMBL16979799 0.88 TDP1 (0.43) ESR1ESR2TDP1KMT2AACR
SCHEMBL16979784 0.87 TDP1 (0.46) TDP1KMT2AACRPRSS1MEN1
SCHEMBL20202508 0.85 ESR1 (0.46) ESR1ESR2KMT2AACRPRSS1
SCHEMBL16979792 0.85 TDP1 (0.43) TDP1KMT2AACRPRSS1MEN1
SCHEMBL16979809 0.85 TDP1 (0.46) TDP1KMT2AACRPRSS1MEN1
SCHEMBL16979796 0.84 ESR1 (0.47) ESR1ESR2TDP1KMT2AMEN1
SCHEMBL13857926 0.83 ESR1 (0.53) ESR1ESR2KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9778581-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2017-10-03 US disclosed
US-9665020-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2017-05-30 US disclosed
US-20150277249-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2015-10-01 US disclosed
US-20150220007-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2015-08-06 US disclosed