SCHEMBL16601798

SCHEMBL16601798

O=C1C=C/C(=C2/C(Cl)=CC(=O)C(c3ccc(CO)cc3)=C2Cl)C=C1c1ccc(CO)cc1

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
MCL1 Q07820 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
SETD7 Q8WTS6 1/20 0.30
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL16601789 0.75 HSD17B3 (0.46) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL15764229 0.70 MEN1 (0.36) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL16601763 0.70 HSD17B3 (0.49) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL17208874 0.68 KDM4E (0.37) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL16601791 0.62 BACE1 (0.50) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL15764225 0.58 BACE1 (0.68) MEN1MAPTPKMMAPK1KMT2A
SCHEMBL21887168 0.58 MAOA (0.72) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL16601731 0.57 HSD17B3 (0.50) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL16656179 0.57 MAPT (0.43) HSD17B3KDM4EMEN1MAPTPKM
SCHEMBL27169536 0.57 HSD17B3 (0.78) HSD17B3KDM4EMEN1MAPTPKM

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-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