SCHEMBL16601625

SCHEMBL16601625

Cc1ccc2c3c(ccc(-c4ccc(C(C)(C)C)cc4)c13)C(=O)/C2=N/c1ccc(C(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.35
GALR3 O60755 1/20 0.35
TP53 P04637 2/20 0.33
APP P05067 1/20 0.33
KIF11 P52732 3/20 0.32
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.32
BRD4 O60885 1/20 0.31
TDP2 O95551 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
PTGS2 P35354 1/20 0.30
AURKA O14965 2/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL16601689 0.84 PSEN1 (0.36) GALR3APPKIF11MAOBTRPV1
SCHEMBL13292101 0.72 ALDH1A1 (0.47) MAPTGALR3
SCHEMBL14666775 0.66 KIF11 (0.44) MAPTTP53APPKIF11TRPV1
SCHEMBL12114097 0.65 KIF11 (0.43) MAPTTP53APPKIF11MAOB
SCHEMBL13761760 0.63 KIF11 (0.62) KIF11MAOBTRPV1
SCHEMBL12110357 0.62 KDM1A (0.43) MAPTTP53APPKIF11MAOB
SCHEMBL3804212 0.62 ALDH1A1 (0.44) MAPTBRD4
SCHEMBL3804209 0.62 ALDH1A1 (0.44) MAPTBRD4
SCHEMBL13302004 0.61 GALR3 (0.43) MAPTGALR3
SCHEMBL70053 0.61 TRPV1 (0.55) KIF11TRPV1

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