SCHEMBL16601651

SCHEMBL16601651

CCc1cccc(C)c1N1C(=O)c2cc(-c3cccc([N+](=O)[O-])c3)c3c4c(cc(-c5cccc([N+](=O)[O-])c5)c(c24)C1=O)C(=O)N(C(CC)CO)C3=O

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.35
DPP4 P27487 2/20 0.35
AKR1C3 P42330 4/20 0.35
AKR1C2 P52895 4/20 0.35
MAPT P10636 5/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HTT P42858 1/20 0.34
MAOA P21397 1/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.32
SCN2A Q99250 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
WEE1 P30291 1/20 0.31

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
SCHEMBL16656161 0.84 PGR (0.38) ANPEPDPP4AKR1C3AKR1C2MAPT
SCHEMBL15764203 0.83 ANPEP (0.46) ANPEPDPP4MAPTLMNAL3MBTL1
SCHEMBL16866456 0.82 SCN2A (0.36) AKR1C3AKR1C2L3MBTL1POLBTDP1
SCHEMBL16601640 0.82 DPP4 (0.39) ANPEPDPP4MEN1KMT2A
SCHEMBL16601636 0.81 DPP4 (0.41) ANPEPDPP4MAPTHTTALDH1A1
SCHEMBL16601987 0.78 DPP4 (0.39) ANPEPDPP4MEN1KMT2A
SCHEMBL12629126 0.77 DPP4 (0.45) ANPEPDPP4MAPTL3MBTL1HTT
SCHEMBL16601823 0.76 ANPEP (0.38) ANPEPDPP4MAPTHTTALDH1A1
SCHEMBL16601805 0.76 DPP4 (0.40) ANPEPDPP4MAPTL3MBTL1HTT
SCHEMBL15764232 0.74 DPP4 (0.42) ANPEPDPP4MAPTALDH1A1MEN1

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