SCHEMBL16601731

SCHEMBL16601731

O=C1C=CC(=C2C=CC(=O)C(c3ccc(O)cc3)=C2)C=C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.50
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
KDM4E B2RXH2 4/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.47
MCL1 Q07820 1/20 0.47
SETD7 Q8WTS6 5/20 0.45
BACE1 P56817 3/20 0.45
PTPN1 P18031 1/20 0.45
HPGD P15428 2/20 0.43
NPC1 O15118 1/20 0.43
MITF O75030 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43

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
SCHEMBL16601791 0.93 BACE1 (0.50) HSD17B3MAOAMAOBKDM4EMAPT
SCHEMBL10765128 0.87 HSD17B3 (0.64) HSD17B3MAOAMAOBKDM4EMAPT
SCHEMBL16601789 0.81 HSD17B3 (0.46) HSD17B3MAOAMAOBKDM4EMAPT
SCHEMBL28864094 0.80 HSD17B3 (0.56) HSD17B3MAOAMAOBKDM4EMAPT
SCHEMBL20833402 0.77 PTPRC (0.40) MAOAMAOBKDM4EMAPTMEN1
SCHEMBL27169536 0.76 HSD17B3 (0.78) HSD17B3MAOAMAOBKDM4EMAPT
SCHEMBL17208872 0.73 KDM4E (0.40) HSD17B3MAOAMAOBKDM4EMAPT
SCHEMBL21887168 0.72 MAOA (0.72) HSD17B3MAOAMAOBKDM4EMAPT
Benzoquinone SCHEMBL285749 0.71 MAPT (0.64) MAOAMAOBKDM4EMAPTMEN1
Benzoquinone SCHEMBL51208 0.71 MAPT (0.64) MAOAMAOBKDM4EMAPTMEN1

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-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed