SCHEMBL4926537

SCHEMBL4926537

CCOC(=O)c1cccc(N(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.52
CYP4A11 Q02928 1/20 0.52
MAPT P10636 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 2/20 0.51
NPC1 O15118 2/20 0.51
ALDH1A1 P00352 1/20 0.51
MAPK1 P28482 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
POLB P06746 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
GAA P10253 1/20 0.50
PKM P14618 1/20 0.50
MEN1 O00255 1/20 0.49

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
SCHEMBL6445553 0.98 MAPT (0.53) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL12374369 0.91 ALDH1A1 (0.52) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL6440419 0.88 LMNA (0.50) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL12545286 0.87 MAPT (0.49) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL3236449 0.85 MAPT (0.65) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL32685467 0.85 MAPT (0.65) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL21784421 0.85 KMT2A (0.61) MAPTRAB9ASMN1; SMN2LMNANPC1
SCHEMBL1170395 0.84 SIRT2 (0.48) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL1574716 0.84 CYP4F2 (0.52) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2
SCHEMBL10106410 0.84 PTPN1 (0.58) CYP4F2CYP4A11MAPTRAB9ASMN1; SMN2

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-20080054794-A1 Organic Electroluminescence Device, Image Display Apparatus and Lighting Apparatus Including the Same, Charge Transport Material and Charge Transport Layer Forming Ink Including the Same Fujiki, Michiya (JP) 2008-03-06 US disclosed
WO-2006001469-A2 ORGANIC ELECTROLUMINESCENCE DEVICE, IMAGE DISPLAY APPARATUS AND LIGHTING APPARATUS INCLUDING THE SAME CHARGE TRANSPORT MATERIAL SHARP KABUSHIKI KAISHA (JP) 2006-01-05 WO disclosed