SCHEMBL16602016

SCHEMBL16602016

O=C(O)c1cccc(-c2cnc3c(c2)C(=O)C(=O)c2cc(-c4cccc(C(=O)O)c4)cnc2-3)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 3/20 0.56
AXL P30530 3/20 0.54
KMO O15229 2/20 0.53
DDT P30046 1/20 0.50
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
IKBKE Q14164 1/20 0.46
TBK1 Q9UHD2 1/20 0.46
LDHA P00338 1/20 0.45
LDHB P07195 1/20 0.45
MAPK1 P28482 2/20 0.43
MAP2K4 P45985 1/20 0.43
MAPKAPK3 Q16644 1/20 0.43
MAPK6 Q16659 1/20 0.43
CD74 P04233 1/20 0.43
MIF P14174 1/20 0.43
CDC7 O00311 1/20 0.43
PLK4 O00444 1/20 0.43
CHEK1 O14757 1/20 0.43
AURKA O14965 1/20 0.43

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
SCHEMBL12556925 0.80 NPC1 (0.50) MAP4K4AXLIKBKETBK1PLK4
SCHEMBL16602023 0.79 KMO (0.61) MAP4K4KMORXRARXRB
SCHEMBL14758859 0.76 KMO (0.58) MAP4K4AXLKMODDTRXRA
SCHEMBL16601738 0.76 MAP4K4 (0.56) MAP4K4AXLNTRK1FYNDYRK1A
SCHEMBL71238 0.76 KMO (0.86) KMORXRARXRBCD74MIF
SCHEMBL30725957 0.76 KMO (0.86) KMORXRARXRBCD74MIF
SCHEMBL29904709 0.76 KMO (0.86) KMORXRARXRBCD74MIF
SCHEMBL29911642 0.75 KMO (0.74) MAP4K4AXLKMODDTRXRA
SCHEMBL29725579 0.75 KMO (0.74) MAP4K4AXLKMODDTRXRA
SCHEMBL15764214 0.75 PTPRC (0.70) KMORXRARXRBCHEK1

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 1 patent. 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