SCHEMBL16601758

SCHEMBL16601758

OCc1ccc(N=C2c3cccc(-c4ccccc4)c3-c3c2cccc3-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
TSHR P16473 1/20 0.41
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
HNF4A P41235 1/20 0.38
LTA4H P09960 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
FYN P06241 2/20 0.34
HPGD P15428 1/20 0.33
BCL2L1 Q07817 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
CNR2 P34972 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32

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
SCHEMBL16601744 0.84 ALDH1A1 (0.43) ALDH1A1TSHRPDCD1CD274
SCHEMBL16601755 0.83 ALDH1A1 (0.68) ALDH1A1TSHRLTA4HNOS3NOS1
SCHEMBL16601743 0.77 MEN1 (0.49) ALDH1A1TSHRPDCD1CD274NOS3
SCHEMBL16601699 0.75 S100A4 (0.48) ALDH1A1HPGD
SCHEMBL16656346 0.74 FYN (0.42) ALDH1A1TSHRFYNHSD17B10CNR2
SCHEMBL16601752 0.74 FYN (0.42) ALDH1A1TSHRFYNHSD17B10CNR2
SCHEMBL35773 0.72 TSHR (0.62) ALDH1A1TSHRPDCD1CD274LTA4H
SCHEMBL12111787 0.72 ALDH1A1 (0.38) ALDH1A1PDCD1CD274CNR2
Parahydroxybenzyl Alcohol SCHEMBL28122521 0.70 BCL2L1 (0.48) ALDH1A1TSHRPDCD1CD274HNF4A
SCHEMBL70274 0.68 TSHR (0.68) ALDH1A1TSHRLTA4HFYNBCL2L1

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