SCHEMBL16601763

SCHEMBL16601763

O=C1C=CC(=C2C=C(c3ccccc3)C(=O)C(c3ccccc3)=C2)C=C1c1ccc(CO)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.49
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
BACE1 P56817 7/20 0.42
PTPN1 P18031 4/20 0.40
PTPRC P08575 1/20 0.38
PTPRF P10586 1/20 0.38
CDC25B P30305 1/20 0.38
TSHR P16473 2/20 0.36
PDE4B Q07343 1/20 0.34
ABCC4 O15439 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
PTGS1 P23219 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 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
SCHEMBL15764229 0.83 MEN1 (0.36) HSD17B3MAOAMAOBCDC25BLMNA
SCHEMBL16601789 0.82 HSD17B3 (0.46) HSD17B3MAOAMAOBGAAKDM4E
SCHEMBL21887168 0.79 MAOA (0.72) HSD17B3MAOAMAOBBACE1PTPN1
SCHEMBL15764225 0.74 BACE1 (0.68) MAOAMAOBBACE1PTPN1PTPRC
SCHEMBL16601629 0.74 BACE1 (0.48) HSD17B3MAOAMAOBBACE1PTPN1
SCHEMBL134702 0.74 BACE1 (0.73) HSD17B3MAOAMAOBBACE1PTPN1
SCHEMBL16601799 0.72 EPHX2 (0.47) TSHRMAPT
SCHEMBL17208874 0.71 KDM4E (0.37) HSD17B3MAOAMAOBBACE1KDM4E
SCHEMBL16601798 0.70 HSD17B3 (0.32) HSD17B3MAOAMAOBGAAKDM4E
SCHEMBL16601791 0.69 BACE1 (0.50) HSD17B3MAOAMAOBBACE1PTPN1

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