SCHEMBL16601789

SCHEMBL16601789

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.46
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
PKM P14618 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
MCL1 Q07820 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
SETD7 Q8WTS6 6/20 0.42
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BRD4 O60885 1/20 0.31
HDAC2 Q92769 1/20 0.30
MKNK1 Q9BUB5 1/20 0.30

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
SCHEMBL15764229 0.82 MEN1 (0.36) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL16601763 0.82 HSD17B3 (0.49) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL16601731 0.81 HSD17B3 (0.50) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL17208874 0.76 KDM4E (0.37) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL16601798 0.75 HSD17B3 (0.32) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL16601791 0.73 BACE1 (0.50) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL27169536 0.72 HSD17B3 (0.78) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL21887168 0.69 MAOA (0.72) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL10765128 0.67 HSD17B3 (0.64) HSD17B3MAOAMAOBKDM4EMEN1
SCHEMBL15764225 0.66 BACE1 (0.68) MAOAMAOBMEN1MAPTPKM

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-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